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

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[2-(3-thienyl)thiazol-4-yl]acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-[2-(3-thiophenyl)-4-thiazolyl]acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[2-(3-thienyl)thiazol-4-yl]acetamide Formula: C22H25N3O4S3 MolecularWeight: 491.6466

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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=CSC=C4

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O4S3/c1-29-20-7-6-18(32(27,28)25-9-4-2-3-5-10-25)13-19(20)24-21(26)12-17-15-31-22(23-17)16-8-11-30-14-16/h6-8,11,13-15H,2-5,9-10,12H2,1H3,(H,24,26)