1-(3,4-dimethoxyphenyl)sulfonyl-4-(phenylmethyl)-1,4-diazepane

Systemtic Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-(phenylmethyl)-1,4-diazepane Openeye Name: 1-benzyl-4-(3,4-dimethoxyphenyl)sulfonyl-1,4-diazepane CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-(phenylmethyl)-1,4-diazepane IUPAC Name: 1-benzyl-4-(3,4-dimethoxyphenyl)sulfonyl-1,4-diazepane Traditional Name: 1-benzyl-4-(3,4-dimethoxyphenyl)sulfonyl-1,4-diazepane Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C20H26N2O4S/c1-25-19-10-9-18(15-20(19)26-2)27(23,24)22-12-6-11-21(13-14-22)16-17-7-4-3-5-8-17/h3-5,7-10,15H,6,11-14,16H2,1-2H3