6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone

C120H137Cl6N13O7S6 — CID 160901423

IUPAC6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESCCC1CCCCN1C(=O)c1cccc(CSc2cccc(C)c2Cl)n1.Cc1cccc(SCc2cccc(C(=O)N3C(C)CCCC3C)n2)c1Cl.Cc1cccc(SCc2cccc(C(=O)N3CCCC(C(N)=O)C3)n2)c1Cl.Cc1cccc(SCc2cccc(C(=O)N3CCCC3)n2)c1Cl.Cc1cccc(SCc2cccc(C(=O)N3CCCCC3)n2)c1Cl.Cc1cccc(SCc2cccc(C(=O)NC3CCC(C)CC3)n2)c1Cl
InChIInChI=1S/3C21H25ClN2OS.C20H22ClN3O2S.C19H21ClN2OS.C18H19ClN2OS/c1-14-7-4-12-19(20(14)22)26-13-17-10-6-11-18(23-17)21(25)24-15(2)8-5-9-16(24)3;1-14-9-11-16(12-10-14)24-21(25)18-7-4-6-17(23-18)13-26-19-8-3-5-15(2)20(19)22;1-3-17-10-4-5-13-24(17)21(25)18-11-7-9-16(23-18)14-26-19-12-6-8-15(2)20(19)22;1-13-5-2-9-17(18(13)21)27-12-15-7-3-8-16(23-15)20(26)24-10-4-6-14(11-24)19(22)25;1-14-7-5-10-17(18(14)20)24-13-15-8-6-9-16(21-15)19(23)22-11-3-2-4-12-22;1-13-6-4-9-16(17(13)19)23-12-14-7-5-8-15(20-14)18(22)21-10-2-3-11-21/h4,6-7,10-12,15-16H,5,8-9,13H2,1-3H3;3-8,14,16H,9-13H2,1-2H3,(H,24,25);6-9,11-12,17H,3-5,10,13-14H2,1-2H3;2-3,5,7-9,14H,4,6,10-12H2,1H3,(H2,22,25);5-10H,2-4,11-13H2,1H3;4-9H,2-3,10-12H2,1H3
InChIKeySPOBIKAWSJQOMI-UHFFFAOYSA-N
MW2278.62 g/mol
LogP30.33
Rot. Bonds27

About 6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone

6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone (PubChem CID 160901423) has the molecular formula C120H137Cl6N13O7S6 and a molecular weight of 2278.62 g/mol. Its IUPAC name is 6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone
PubChem CID160901423
Molecular FormulaC120H137Cl6N13O7S6
Molecular Weight2278.62 g/mol
Exact Mass2273.72
IUPAC Name6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone
SMILESCCC1CCCCN1C(=O)c1cccc(CSc2cccc(C)c2Cl)n1.Cc1cccc(SCc2cccc(C(=O)N3C(C)CCCC3C)n2)c1Cl.Cc1cccc(SCc2cccc(C(=O)N3CCCC(C(N)=O)C3)n2)c1Cl.Cc1cccc(SCc2cccc(C(=O)N3CCCC3)n2)c1Cl.Cc1cccc(SCc2cccc(C(=O)N3CCCCC3)n2)c1Cl.Cc1cccc(SCc2cccc(C(=O)NC3CCC(C)CC3)n2)c1Cl
InChIInChI=1S/3C21H25ClN2OS.C20H22ClN3O2S.C19H21ClN2OS.C18H19ClN2OS/c1-14-7-4-12-19(20(14)22)26-13-17-10-6-11-18(23-17)21(25)24-15(2)8-5-9-16(24)3;1-14-9-11-16(12-10-14)24-21(25)18-7-4-6-17(23-18)13-26-19-8-3-5-15(2)20(19)22;1-3-17-10-4-5-13-24(17)21(25)18-11-7-9-16(23-18)14-26-19-12-6-8-15(2)20(19)22;1-13-5-2-9-17(18(13)21)27-12-15-7-3-8-16(23-15)20(26)24-10-4-6-14(11-24)19(22)25;1-14-7-5-10-17(18(14)20)24-13-15-8-6-9-16(21-15)19(23)22-11-3-2-4-12-22;1-13-6-4-9-16(17(13)19)23-12-14-7-5-8-15(20-14)18(22)21-10-2-3-11-21/h4,6-7,10-12,15-16H,5,8-9,13H2,1-3H3;3-8,14,16H,9-13H2,1-2H3,(H,24,25);6-9,11-12,17H,3-5,10,13-14H2,1-2H3;2-3,5,7-9,14H,4,6,10-12H2,1H3,(H2,22,25);5-10H,2-4,11-13H2,1H3;4-9H,2-3,10-12H2,1H3
InChIKeySPOBIKAWSJQOMI-UHFFFAOYSA-N
XLogP30.33
TPSA251.08 Ų
H-Bond Donors2
H-Bond Acceptors19
Rotatable Bonds27
Heavy Atoms152
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002278.62
LogP ≤ 530.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1019

Analyze 6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone with MolForge

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Launch Full Analysis

Related Compounds

azepan-1-yl-[6-[(2,5-dichloro-4-methylphenyl)sulfanylmethyl]-2-pyridinyl]methanone;N-cyclohexyl-6-[(2,5-dichloro-4-methylphenyl)sulfanylmethyl]pyridine-2-carboxamide;[6-[(2,5-dichloro-4-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2,5-dichloro-4-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;[6-[(2,5-dichloro-4-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2,5-dichloro-4-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-methylpiperidin-1-yl)methanone
CID 159801813
[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone
CID 58211679
[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(4-hydroxypiperidin-1-yl)methanone
CID 58211437
6-[(2-chloro-6-methylphenyl)sulfanylmethyl]-N-cyclohexylpyridine-2-carboxamide
CID 11988639
[6-[(2,5-dichloro-4-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-methylpiperidin-1-yl)methanone
CID 58210539
N-(2,6-dimethylphenyl)-6-(2-ethylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109099638
[6-[(2,6-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone
CID 58211130
[6-[(2,3-dichlorophenyl)sulfanylmethyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone
CID 58210803
N-cyclopropyl-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109093812
N-(3-chloro-4-methylphenyl)-6-(2-ethylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109099656
N-cyclopentyl-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109094934
azepan-1-yl-[6-[(2,4-dimethylphenyl)sulfanylmethyl]-2-pyridinyl]methanone
CID 58210853

Frequently Asked Questions

What is the IUPAC name of 6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone?
The IUPAC name of 6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone (CID 160901423) is 6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for 6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for 6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone is CCC1CCCCN1C(=O)c1cccc(CSc2cccc(C)c2Cl)n1.Cc1cccc(SCc2cccc(C(=O)N3C(C)CCCC3C)n2)c1Cl.Cc1cccc(SCc2cccc(C(=O)N3CCCC(C(N)=O)C3)n2)c1Cl.Cc1cccc(SCc2cccc(C(=O)N3CCCC3)n2)c1Cl.Cc1cccc(SCc2cccc(C(=O)N3CCCCC3)n2)c1Cl.Cc1cccc(SCc2cccc(C(=O)NC3CCC(C)CC3)n2)c1Cl.
What is the InChIKey of 6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone?
The InChIKey is SPOBIKAWSJQOMI-UHFFFAOYSA-N. The full InChI is InChI=1S/3C21H25ClN2OS.C20H22ClN3O2S.C19H21ClN2OS.C18H19ClN2OS/c1-14-7-4-12-19(20(14)22)26-13-17-10-6-11-18(23-17)21(25)24-15(2)8-5-9-16(24)3;1-14-9-11-16(12-10-14)24-21(25)18-7-4-6-17(23-18)13-26-19-8-3-5-15(2)20(19)22;1-3-17-10-4-5-13-24(17)21(25)18-11-7-9-16(23-18)14-26-19-12-6-8-15(2)20(19)22;1-13-5-2-9-17(18(13)21)27-12-15-7-3-8-16(23-15)20(26)24-10-4-6-14(11-24)19(22)25;1-14-7-5-10-17(18(14)20)24-13-15-8-6-9-16(21-15)19(23)22-11-3-2-4-12-22;1-13-6-4-9-16(17(13)19)23-12-14-7-5-8-15(20-14)18(22)21-10-2-3-11-21/h4,6-7,10-12,15-16H,5,8-9,13H2,1-3H3;3-8,14,16H,9-13H2,1-2H3,(H,24,25);6-9,11-12,17H,3-5,10,13-14H2,1-2H3;2-3,5,7-9,14H,4,6,10-12H2,1H3,(H2,22,25);5-10H,2-4,11-13H2,1H3;4-9H,2-3,10-12H2,1H3.
What are the key properties of 6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone?
6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone has a molecular weight of 2278.62 g/mol, XLogP of 30.33, 27 rotatable bonds, 2 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-N-(4-methylcyclohexyl)pyridine-2-carboxamide;1-[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]pyridine-2-carbonyl]piperidine-3-carboxamide;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2,6-dimethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-piperidin-1-ylmethanone;[6-[(2-chloro-3-methylphenyl)sulfanylmethyl]-2-pyridinyl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 160901423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).