N-[1-[[3-(azepan-1-ylsulfonyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-[[3-(azepan-1-ylsulfonyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-[3-(azepan-1-ylsulfonyl)anilino]-1-methyl-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[1-[3-(1-azepanylsulfonyl)anilino]-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[1-[3-(azepan-1-ylsulfonyl)anilino]-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-[3-(azepan-1-ylsulfonyl)anilino]-2-keto-1-methyl-ethyl]thiophene-2-carboxamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H25N3O4S2/c1-15(21-20(25)18-10-7-13-28-18)19(24)22-16-8-6-9-17(14-16)29(26,27)23-11-4-2-3-5-12-23/h6-10,13-15H,2-5,11-12H2,1H3,(H,21,25)(H,22,24)