N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[2-(3-pyridyl)thiazol-4-yl]acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-[2-(3-pyridinyl)-4-thiazolyl]acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[2-(3-pyridyl)thiazol-4-yl]acetamide Formula: C23H26N4O4S2 MolecularWeight: 486.60694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CC3=CSC(=N3)C4=CN=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CC3=CSC(=N3)C4=CN=CC=C4

InChI

InChI=1S/C23H26N4O4S2/c1-31-21-9-8-19(33(29,30)27-11-4-2-3-5-12-27)14-20(21)26-22(28)13-18-16-32-23(25-18)17-7-6-10-24-15-17/h6-10,14-16H,2-5,11-13H2,1H3,(H,26,28)