N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide

C20H19N3O3S2 — CID 55642635

IUPACN-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide
SMILESCC1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)N(C)c2nccs2)c1
InChIInChI=1S/C20H19N3O3S2/c1-14-12-15-6-3-4-9-18(15)23(14)28(25,26)17-8-5-7-16(13-17)19(24)22(2)20-21-10-11-27-20/h3-11,13-14H,12H2,1-2H3
InChIKeyCVVDLRSIZVCCCH-UHFFFAOYSA-N
MW413.52 g/mol
LogP3.56
Rot. Bonds4

About N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide

N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 55642635) has the molecular formula C20H19N3O3S2 and a molecular weight of 413.52 g/mol. Its IUPAC name is N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound NameN-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide
PubChem CID55642635
Molecular FormulaC20H19N3O3S2
Molecular Weight413.52 g/mol
Exact Mass413.09
IUPAC NameN-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide
SMILESCC1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)N(C)c2nccs2)c1
InChIInChI=1S/C20H19N3O3S2/c1-14-12-15-6-3-4-9-18(15)23(14)28(25,26)17-8-5-7-16(13-17)19(24)22(2)20-21-10-11-27-20/h3-11,13-14H,12H2,1-2H3
InChIKeyCVVDLRSIZVCCCH-UHFFFAOYSA-N
XLogP3.56
TPSA70.58 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.52
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-bromo-2-methylphenyl)-N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzamide
CID 60575082
3-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]-N,N-bis(prop-2-enyl)benzamide
CID 2344808
3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(pyridin-4-ylmethyl)benzamide
CID 4175707
3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-propylbenzamide
CID 109062095
azocan-1-yl-[3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]phenyl]methanone
CID 55332107
N-[1-(3,4-difluorophenyl)ethyl]-N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzamide
CID 55509546
methyl 3-[[3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoyl]-(2-methylpropyl)amino]propanoate
CID 55890650
3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-[(4-pyrazol-1-ylphenyl)methyl]benzamide
CID 55697733
N'-[3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoyl]-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide
CID 55455151
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzamide
CID 46823673
3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-[(1-methylimidazol-2-yl)-phenylmethyl]benzamide
CID 46512935
3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 4524824

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide (CID 55642635) is N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide is CC1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)N(C)c2nccs2)c1.
What is the InChIKey of N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is CVVDLRSIZVCCCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3S2/c1-14-12-15-6-3-4-9-18(15)23(14)28(25,26)17-8-5-7-16(13-17)19(24)22(2)20-21-10-11-27-20/h3-11,13-14H,12H2,1-2H3.
What are the key properties of N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide?
N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 413.52 g/mol, XLogP of 3.56, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 55642635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).