N-(4-azanylcyclohexyl)-4-[cyclopropylcarbonyl(phenethyl)amino]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-[cyclopropylcarbonyl(phenethyl)amino]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[cyclopropanecarbonyl(phenethyl)amino]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[[cyclopropyl(oxo)methyl]-phenethylamino]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[cyclopropanecarbonyl(phenethyl)amino]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[cyclopropanecarbonyl(phenethyl)amino]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C28H36N4O3S MolecularWeight: 508.67544

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC=CS4)C(=O)NC5CCC(CC5)N

Isomeric SMILES

C1CC1C(=O)N(CCC2=CC=CC=C2)C3CC(N(C3)C(=O)C4=CC=CS4)C(=O)NC5CCC(CC5)N

InChI

InChI=1S/C28H36N4O3S/c29-21-10-12-22(13-11-21)30-26(33)24-17-23(18-32(24)28(35)25-7-4-16-36-25)31(27(34)20-8-9-20)15-14-19-5-2-1-3-6-19/h1-7,16,20-24H,8-15,17-18,29H2,(H,30,33)