2-[(4-chlorophenyl)carbamoylamino]-N-[3-methyl-4-(2-methylsulfanylpyrrolidin-1-yl)phenyl]-2-phenyl-ethanamide iodide

Systemtic Name: 2-[(4-chlorophenyl)carbamoylamino]-N-[3-methyl-4-(2-methylsulfanylpyrrolidin-1-yl)phenyl]-2-phenyl-ethanamide iodide Openeye Name: 2-[(4-chlorophenyl)carbamoylamino]-N-[3-methyl-4-(2-methylsulfanylpyrrolidin-1-yl)phenyl]-2-phenyl-acetamide iodide CAS Name: 2-[[(4-chloroanilino)-oxomethyl]amino]-N-[3-methyl-4-[2-(methylthio)-1-pyrrolidinyl]phenyl]-2-phenylacetamide iodide IUPAC Name: 2-[(4-chlorophenyl)carbamoylamino]-N-[3-methyl-4-(2-methylsulfanylpyrrolidin-1-yl)phenyl]-2-phenylacetamide iodide Traditional Name: 2-[(4-chlorophenyl)carbamoylamino]-N-[3-methyl-4-[2-(methylthio)pyrrolidino]phenyl]-2-phenyl-acetamide iodide Formula: C27H29ClIN4O2S- MolecularWeight: 635.96723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C(C2=CC=CC=C2)NC(=O)NC3=CC=C(C=C3)Cl)N4CCCC4SC.[I-]

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C(C2=CC=CC=C2)NC(=O)NC3=CC=C(C=C3)Cl)N4CCCC4SC.[I-]

InChI

InChI=1S/C27H29ClN4O2S.HI/c1-18-17-22(14-15-23(18)32-16-6-9-24(32)35-2)29-26(33)25(19-7-4-3-5-8-19)31-27(34)30-21-12-10-20(28)11-13-21;/h3-5,7-8,10-15,17,24-25H,6,9,16H2,1-2H3,(H,29,33)(H2,30,31,34);1H/p-1