2-[(3,4-dimethylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]ethanamide Openeye Name: 2-[3,4-dimethyl-N-(p-tolylsulfonyl)anilino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide CAS Name: 2-(3,4-dimethyl-N-(4-methylphenyl)sulfonylanilino)-N-[[4-(1-pyrrolidinyl)phenyl]methyl]acetamide IUPAC Name: 2-(3,4-dimethyl-N-(4-methylphenyl)sulfonylanilino)-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide Traditional Name: 2-(3,4-dimethyl-N-tosyl-anilino)-N-(4-pyrrolidinobenzyl)acetamide Formula: C28H33N3O3S MolecularWeight: 491.64492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=C(C=C2)N3CCCC3)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=C(C=C2)N3CCCC3)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C28H33N3O3S/c1-21-6-14-27(15-7-21)35(33,34)31(26-11-8-22(2)23(3)18-26)20-28(32)29-19-24-9-12-25(13-10-24)30-16-4-5-17-30/h6-15,18H,4-5,16-17,19-20H2,1-3H3,(H,29,32)