2-(4-methoxyphenyl)sulfonyl-2-(7-oxidanylideneazepan-4-yl)-2-[(phenylmethyl)amino]ethanamide

Systemtic Name: 2-(4-methoxyphenyl)sulfonyl-2-(7-oxidanylideneazepan-4-yl)-2-[(phenylmethyl)amino]ethanamide Openeye Name: 2-(benzylamino)-2-(4-methoxyphenyl)sulfonyl-2-(7-oxoazepan-4-yl)acetamide CAS Name: 2-(4-methoxyphenyl)sulfonyl-2-(7-oxo-4-azepanyl)-2-[(phenylmethyl)amino]acetamide IUPAC Name: 2-(benzylamino)-2-(4-methoxyphenyl)sulfonyl-2-(7-oxoazepan-4-yl)acetamide Traditional Name: 2-(benzylamino)-2-(7-ketoazepan-4-yl)-2-(4-methoxyphenyl)sulfonyl-acetamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C(C2CCC(=O)NCC2)(C(=O)N)NCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C(C2CCC(=O)NCC2)(C(=O)N)NCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O5S/c1-30-18-8-10-19(11-9-18)31(28,29)22(21(23)27,17-7-12-20(26)24-14-13-17)25-15-16-5-3-2-4-6-16/h2-6,8-11,17,25H,7,12-15H2,1H3,(H2,23,27)(H,24,26)