2-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]indol-3-yl]-N-(2-methylsulfanylphenyl)-2-oxidanylidene-ethanamide

Systemtic Name: 2-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]indol-3-yl]-N-(2-methylsulfanylphenyl)-2-oxidanylidene-ethanamide Openeye Name: 2-[1-[2-(azepan-1-yl)-2-oxo-ethyl]indol-3-yl]-N-(2-methylsulfanylphenyl)-2-oxo-acetamide CAS Name: 2-[1-[2-(1-azepanyl)-2-oxoethyl]-3-indolyl]-N-[2-(methylthio)phenyl]-2-oxoacetamide IUPAC Name: 2-[1-[2-(azepan-1-yl)-2-oxoethyl]indol-3-yl]-N-(2-methylsulfanylphenyl)-2-oxoacetamide Traditional Name: 2-[1-[2-(azepan-1-yl)-2-keto-ethyl]indol-3-yl]-2-keto-N-[2-(methylthio)phenyl]acetamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCCCCC4

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCCCCC4

InChI

InChI=1S/C25H27N3O3S/c1-32-22-13-7-5-11-20(22)26-25(31)24(30)19-16-28(21-12-6-4-10-18(19)21)17-23(29)27-14-8-2-3-9-15-27/h4-7,10-13,16H,2-3,8-9,14-15,17H2,1H3,(H,26,31)