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

Systemtic Name: N-(4-azanylcyclohexyl)-4-[cyclopropyl-(4-methoxyphenyl)carbonyl-amino]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[cyclopropyl-(4-methoxybenzoyl)amino]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[cyclopropyl-[(4-methoxyphenyl)-oxomethyl]amino]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[cyclopropyl-(4-methoxybenzoyl)amino]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[cyclopropyl(p-anisoyl)amino]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C27H34N4O4S MolecularWeight: 510.64826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(C2CC2)C3CC(N(C3)C(=O)C4=CC=CS4)C(=O)NC5CCC(CC5)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(C2CC2)C3CC(N(C3)C(=O)C4=CC=CS4)C(=O)NC5CCC(CC5)N

InChI

InChI=1S/C27H34N4O4S/c1-35-22-12-4-17(5-13-22)26(33)31(20-10-11-20)21-15-23(25(32)29-19-8-6-18(28)7-9-19)30(16-21)27(34)24-3-2-14-36-24/h2-5,12-14,18-21,23H,6-11,15-16,28H2,1H3,(H,29,32)