N-(4-azanylcyclohexyl)-4-[(2-methylphenyl)methyl-(thiophen-2-ylmethyl)amino]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-[(2-methylphenyl)methyl-(thiophen-2-ylmethyl)amino]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[o-tolylmethyl(2-thienylmethyl)amino]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[(2-methylphenyl)methyl-(thiophen-2-ylmethyl)amino]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[(2-methylphenyl)methyl-(thiophen-2-ylmethyl)amino]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[(2-methylbenzyl)-(2-thenyl)amino]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C29H36N4O2S2 MolecularWeight: 536.75174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CC2=CC=CS2)C3CC(N(C3)C(=O)C4=CC=CS4)C(=O)NC5CCC(CC5)N

Isomeric SMILES

CC1=CC=CC=C1CN(CC2=CC=CS2)C3CC(N(C3)C(=O)C4=CC=CS4)C(=O)NC5CCC(CC5)N

InChI

InChI=1S/C29H36N4O2S2/c1-20-6-2-3-7-21(20)17-32(19-25-8-4-14-36-25)24-16-26(28(34)31-23-12-10-22(30)11-13-23)33(18-24)29(35)27-9-5-15-37-27/h2-9,14-15,22-24,26H,10-13,16-19,30H2,1H3,(H,31,34)