N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-(4-methylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-(4-methylphenyl)-4-oxidanylidene-butanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-oxo-4-(p-tolyl)butanamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-4-(4-methylphenyl)-4-oxobutanamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-4-(4-methylphenyl)-4-oxobutanamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-keto-4-(p-tolyl)butyramide Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C24H30N2O5S/c1-18-7-9-19(10-8-18)22(27)12-14-24(28)25-21-17-20(11-13-23(21)31-2)32(29,30)26-15-5-3-4-6-16-26/h7-11,13,17H,3-6,12,14-16H2,1-2H3,(H,25,28)