3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]propanamide

Systemtic Name: 3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]propanamide Openeye Name: 3-[4-methyl-N-(p-tolylsulfonyl)anilino]-N-[(2-pyrrolidin-1-yl-4-pyridyl)methyl]propanamide CAS Name: 3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)-N-[[2-(1-pyrrolidinyl)-4-pyridinyl]methyl]propanamide IUPAC Name: 3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]propanamide Traditional Name: 3-(4-methyl-N-tosyl-anilino)-N-[(2-pyrrolidino-4-pyridyl)methyl]propionamide Formula: C27H32N4O3S MolecularWeight: 492.63298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H32N4O3S/c1-21-5-9-24(10-6-21)31(35(33,34)25-11-7-22(2)8-12-25)18-14-27(32)29-20-23-13-15-28-26(19-23)30-16-3-4-17-30/h5-13,15,19H,3-4,14,16-18,20H2,1-2H3,(H,29,32)