N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide

C136H167N27O26S12 — CID 159009091

About N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide

N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide (PubChem CID 159009091) has the molecular formula C136H167N27O26S12 and a molecular weight of 2980.80 g/mol. Its IUPAC name is N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide.

Molecular Properties

• Compound Name: N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide
• PubChem CID: 159009091
• Molecular Formula: C136H167N27O26S12
• Molecular Weight: 2980.80 g/mol
• Exact Mass: 2977.92
• IUPAC Name: N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide
• SMILES: CC(C)Oc1ccc(S(N)(=O)=O)cc1Nc1nc(-c2ccc(C(=O)CCC3CCN(C)CC3)nc2)cs1.CC(C)Oc1ccc(S(N)(=O)=O)cc1Nc1nc(-c2ccc(C(=O)CCC3CCOCC3)nc2)cs1.COC/C=C/c1ccc(-c2csc(Nc3cc(S(N)(=O)=O)ccc3OC(C)C)n2)cn1.COCCCN(C)c1ccc(-c2csc(Nc3cc(S(N)(=O)=O)ccc3OC(C)C)n2)cn1.COCCCc1ccc(-c2csc(Nc3cc(S(N)(=O)=O)ccc3OC(C)C)n2)cn1.COCCNC(=O)c1ccc(-c2csc(Nc3cc(S(N)(=O)=O)ccc3OC(C)C)n2)cn1
• InChI: InChI=1S/C26H33N5O4S2.C25H30N4O5S2.C22H29N5O4S2.C21H25N5O5S2.C21H26N4O4S2.C21H24N4O4S2/c1-17(2)35-25-9-6-20(37(27,33)34)14-22(25)29-26-30-23(16-36-26)19-5-7-21(28-15-19)24(32)8-4-18-10-12-31(3)13-11-18;1-16(2)34-24-8-5-19(36(26,31)32)13-21(24)28-25-29-22(15-35-25)18-4-6-20(27-14-18)23(30)7-3-17-9-11-33-12-10-17;1-15(2)31-20-8-7-17(33(23,28)29)12-18(20)25-22-26-19(14-32-22)16-6-9-21(24-13-16)27(3)10-5-11-30-4;1-13(2)31-19-7-5-15(33(22,28)29)10-17(19)25-21-26-18(12-32-21)14-4-6-16(24-11-14)20(27)23-8-9-30-3;2*1-14(2)29-20-9-8-17(31(22,26)27)11-18(20)24-21-25-19(13-30-21)15-6-7-16(23-12-15)5-4-10-28-3/h5-7,9,14-18H,4,8,10-13H2,1-3H3,(H,29,30)(H2,27,33,34);4-6,8,13-17H,3,7,9-12H2,1-2H3,(H,28,29)(H2,26,31,32);6-9,12-15H,5,10-11H2,1-4H3,(H,25,26)(H2,23,28,29);4-7,10-13H,8-9H2,1-3H3,(H,23,27)(H,25,26)(H2,22,28,29);6-9,11-14H,4-5,10H2,1-3H3,(H,24,25)(H2,22,26,27);4-9,11-14H,10H2,1-3H3,(H,24,25)(H2,22,26,27)/b;;;;;5-4+
• InChIKey: JSHBVMJVSRZHPO-GNNFJEGJSA-N
• XLogP: 24.08
• TPSA: 759.07 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 52
• Rotatable Bonds: 60
• Heavy Atoms: 201
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2980.80
LogP ≤ 5	24.08
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	52

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide?

The IUPAC name of N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide (CID 159009091) is N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide.

What is the SMILES notation for N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide?

The canonical SMILES for N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide is CC(C)Oc1ccc(S(N)(=O)=O)cc1Nc1nc(-c2ccc(C(=O)CCC3CCN(C)CC3)nc2)cs1.CC(C)Oc1ccc(S(N)(=O)=O)cc1Nc1nc(-c2ccc(C(=O)CCC3CCOCC3)nc2)cs1.COC/C=C/c1ccc(-c2csc(Nc3cc(S(N)(=O)=O)ccc3OC(C)C)n2)cn1.COCCCN(C)c1ccc(-c2csc(Nc3cc(S(N)(=O)=O)ccc3OC(C)C)n2)cn1.COCCCc1ccc(-c2csc(Nc3cc(S(N)(=O)=O)ccc3OC(C)C)n2)cn1.COCCNC(=O)c1ccc(-c2csc(Nc3cc(S(N)(=O)=O)ccc3OC(C)C)n2)cn1.

What is the InChIKey of N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide?

The InChIKey is JSHBVMJVSRZHPO-GNNFJEGJSA-N. The full InChI is InChI=1S/C26H33N5O4S2.C25H30N4O5S2.C22H29N5O4S2.C21H25N5O5S2.C21H26N4O4S2.C21H24N4O4S2/c1-17(2)35-25-9-6-20(37(27,33)34)14-22(25)29-26-30-23(16-36-26)19-5-7-21(28-15-19)24(32)8-4-18-10-12-31(3)13-11-18;1-16(2)34-24-8-5-19(36(26,31)32)13-21(24)28-25-29-22(15-35-25)18-4-6-20(27-14-18)23(30)7-3-17-9-11-33-12-10-17;1-15(2)31-20-8-7-17(33(23,28)29)12-18(20)25-22-26-19(14-32-22)16-6-9-21(24-13-16)27(3)10-5-11-30-4;1-13(2)31-19-7-5-15(33(22,28)29)10-17(19)25-21-26-18(12-32-21)14-4-6-16(24-11-14)20(27)23-8-9-30-3;2*1-14(2)29-20-9-8-17(31(22,26)27)11-18(20)24-21-25-19(13-30-21)15-6-7-16(23-12-15)5-4-10-28-3/h5-7,9,14-18H,4,8,10-13H2,1-3H3,(H,29,30)(H2,27,33,34);4-6,8,13-17H,3,7,9-12H2,1-2H3,(H,28,29)(H2,26,31,32);6-9,12-15H,5,10-11H2,1-4H3,(H,25,26)(H2,23,28,29);4-7,10-13H,8-9H2,1-3H3,(H,23,27)(H,25,26)(H2,22,28,29);6-9,11-14H,4-5,10H2,1-3H3,(H,24,25)(H2,22,26,27);4-9,11-14H,10H2,1-3H3,(H,24,25)(H2,22,26,27)/b;;;;;5-4+.

What are the key properties of N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide?

N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide has a molecular weight of 2980.80 g/mol, XLogP of 24.08, 60 rotatable bonds, 13 hydrogen bond donors, and 52 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-methoxyethyl)-5-[2-(2-propan-2-yloxy-5-sulfamoylanilino)-1,3-thiazol-4-yl]pyridine-2-carboxamide;3-[[4-[6-[(E)-3-methoxyprop-1-enyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-methoxypropyl(methyl)amino]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-(3-methoxypropyl)-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(1-methylpiperidin-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide;3-[[4-[6-[3-(oxan-4-yl)propanoyl]-3-pyridinyl]-1,3-thiazol-2-yl]amino]-4-propan-2-yloxybenzenesulfonamide is sourced from PubChem (CID 159009091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).