3-(4-methylphenyl)-N-[(6-methylpyridin-3-yl)methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 3-(4-methylphenyl)-N-[(6-methylpyridin-3-yl)methyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(6-methyl-3-pyridyl)methyl]-3-(p-tolyl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 3-(4-methylphenyl)-N-[(6-methyl-3-pyridinyl)methyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 3-(4-methylphenyl)-N-[(6-methylpyridin-3-yl)methyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(6-methyl-3-pyridyl)methyl]-3-(p-tolyl)-5-pyrrolidinosulfonyl-benzamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=CC(=C2)S(=O)(=O)N3CCCC3)C(=O)NCC4=CN=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=CC(=C2)S(=O)(=O)N3CCCC3)C(=O)NCC4=CN=C(C=C4)C

InChI

InChI=1S/C25H27N3O3S/c1-18-5-9-21(10-6-18)22-13-23(25(29)27-17-20-8-7-19(2)26-16-20)15-24(14-22)32(30,31)28-11-3-4-12-28/h5-10,13-16H,3-4,11-12,17H2,1-2H3,(H,27,29)