N-[5-[[4-(cyclopropylmethyl)-1,4-diazepan-1-yl]carbonyl]-2-methyl-phenyl]-3,4-dimethoxy-benzenesulfonamide

Systemtic Name: N-[5-[[4-(cyclopropylmethyl)-1,4-diazepan-1-yl]carbonyl]-2-methyl-phenyl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-[5-[4-(cyclopropylmethyl)-1,4-diazepane-1-carbonyl]-2-methyl-phenyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[5-[[4-(cyclopropylmethyl)-1,4-diazepan-1-yl]-oxomethyl]-2-methylphenyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[5-[4-(cyclopropylmethyl)-1,4-diazepane-1-carbonyl]-2-methylphenyl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[5-[4-(cyclopropylmethyl)-1,4-diazepane-1-carbonyl]-2-methyl-phenyl]-3,4-dimethoxy-benzenesulfonamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)CC3CC3)NS(=O)(=O)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)CC3CC3)NS(=O)(=O)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H33N3O5S/c1-18-5-8-20(25(29)28-12-4-11-27(13-14-28)17-19-6-7-19)15-22(18)26-34(30,31)21-9-10-23(32-2)24(16-21)33-3/h5,8-10,15-16,19,26H,4,6-7,11-14,17H2,1-3H3