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

Systemtic Name: N-(4-azanylcyclohexyl)-4-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[benzyl(2-thienylmethyl)amino]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[oxo(thiophen-2-yl)methyl]-4-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[benzyl(thiophen-2-ylmethyl)amino]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[benzyl(2-thenyl)amino]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C28H34N4O2S2 MolecularWeight: 522.72516

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2CC(CN2C(=O)C3=CC=CS3)N(CC4=CC=CC=C4)CC5=CC=CS5

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2CC(CN2C(=O)C3=CC=CS3)N(CC4=CC=CC=C4)CC5=CC=CS5

InChI

InChI=1S/C28H34N4O2S2/c29-21-10-12-22(13-11-21)30-27(33)25-16-23(18-32(25)28(34)26-9-5-15-36-26)31(19-24-8-4-14-35-24)17-20-6-2-1-3-7-20/h1-9,14-15,21-23,25H,10-13,16-19,29H2,(H,30,33)