N-(4-methylphenyl)-3-pyrrolidin-1-ylsulfonyl-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzamide

Systemtic Name: N-(4-methylphenyl)-3-pyrrolidin-1-ylsulfonyl-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzamide Openeye Name: N-(p-tolyl)-3-pyrrolidin-1-ylsulfonyl-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzamide CAS Name: N-(4-methylphenyl)-3-(1-pyrrolidinylsulfonyl)-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzamide IUPAC Name: N-(4-methylphenyl)-3-pyrrolidin-1-ylsulfonyl-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzamide Traditional Name: N-(p-tolyl)-3-pyrrolidinosulfonyl-N-(3,4,5,6-tetrahydro-2H-azepin-7-yl)benzamide Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2=NCCCCC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)N(C2=NCCCCC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C24H29N3O3S/c1-19-11-13-21(14-12-19)27(23-10-3-2-4-15-25-23)24(28)20-8-7-9-22(18-20)31(29,30)26-16-5-6-17-26/h7-9,11-14,18H,2-6,10,15-17H2,1H3