N-(4-azanylcyclohexyl)-4-[cyclopropyl(thiophen-2-ylcarbonyl)amino]-1-(4-fluorophenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-[cyclopropyl(thiophen-2-ylcarbonyl)amino]-1-(4-fluorophenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[cyclopropyl(thiophene-2-carbonyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[cyclopropyl-[oxo(thiophen-2-yl)methyl]amino]-1-[(4-fluorophenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[cyclopropyl(thiophene-2-carbonyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[cyclopropyl(2-thenoyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide Formula: C26H31FN4O3S MolecularWeight: 498.612743

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2CC(CN2C(=O)C3=CC=C(C=C3)F)N(C4CC4)C(=O)C5=CC=CS5

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2CC(CN2C(=O)C3=CC=C(C=C3)F)N(C4CC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C26H31FN4O3S/c27-17-5-3-16(4-6-17)25(33)30-15-21(31(20-11-12-20)26(34)23-2-1-13-35-23)14-22(30)24(32)29-19-9-7-18(28)8-10-19/h1-6,13,18-22H,7-12,14-15,28H2,(H,29,32)