3-pyrrolidin-1-ylpropyl 4-[[4-[(2-methylphenyl)carbonylamino]naphthalen-1-yl]sulfonylamino]piperidine-1-carboxylate

Systemtic Name: 3-pyrrolidin-1-ylpropyl 4-[[4-[(2-methylphenyl)carbonylamino]naphthalen-1-yl]sulfonylamino]piperidine-1-carboxylate Openeye Name: 3-pyrrolidin-1-ylpropyl 4-[[4-[(2-methylbenzoyl)amino]-1-naphthyl]sulfonylamino]piperidine-1-carboxylate CAS Name: 4-[[4-[[(2-methylphenyl)-oxomethyl]amino]-1-naphthalenyl]sulfonylamino]-1-piperidinecarboxylic acid 3-(1-pyrrolidinyl)propyl ester IUPAC Name: 3-pyrrolidin-1-ylpropyl 4-[[4-[(2-methylbenzoyl)amino]naphthalen-1-yl]sulfonylamino]piperidine-1-carboxylate Traditional Name: 4-[[4-(o-toluoylamino)-1-naphthyl]sulfonylamino]piperidine-1-carboxylic acid 3-pyrrolidinopropyl ester Formula: C31H38N4O5S MolecularWeight: 578.72222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C3=CC=CC=C32)S(=O)(=O)NC4CCN(CC4)C(=O)OCCCN5CCCC5

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C3=CC=CC=C32)S(=O)(=O)NC4CCN(CC4)C(=O)OCCCN5CCCC5

InChI

InChI=1S/C31H38N4O5S/c1-23-9-2-3-10-25(23)30(36)32-28-13-14-29(27-12-5-4-11-26(27)28)41(38,39)33-24-15-20-35(21-16-24)31(37)40-22-8-19-34-17-6-7-18-34/h2-5,9-14,24,33H,6-8,15-22H2,1H3,(H,32,36)