2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-N-(2-phenylphenyl)ethanamide

Systemtic Name: 2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-N-(2-phenylphenyl)ethanamide Openeye Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-N-(2-phenylphenyl)acetamide CAS Name: 2-[5-(1-azepanylsulfonyl)-2-methoxyanilino]-N-(2-phenylphenyl)acetamide IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxyanilino]-N-(2-phenylphenyl)acetamide Traditional Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-N-(2-phenylphenyl)acetamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NCC(=O)NC3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NCC(=O)NC3=CC=CC=C3C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O4S/c1-34-26-16-15-22(35(32,33)30-17-9-2-3-10-18-30)19-25(26)28-20-27(31)29-24-14-8-7-13-23(24)21-11-5-4-6-12-21/h4-8,11-16,19,28H,2-3,9-10,17-18,20H2,1H3,(H,29,31)