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

Systemtic Name: N-(4-azanylcyclohexyl)-4-[cyclohexylmethyl(thiophen-2-ylmethyl)amino]-1-(4-fluorophenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[cyclohexylmethyl(2-thienylmethyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[cyclohexylmethyl(thiophen-2-ylmethyl)amino]-1-[(4-fluorophenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[cyclohexylmethyl(thiophen-2-ylmethyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[cyclohexylmethyl(2-thenyl)amino]-1-(4-fluorobenzoyl)pyrrolidine-2-carboxamide Formula: C30H41FN4O2S MolecularWeight: 540.735543

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN(CC2=CC=CS2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)NC5CCC(CC5)N

Isomeric SMILES

C1CCC(CC1)CN(CC2=CC=CS2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)NC5CCC(CC5)N

InChI

InChI=1S/C30H41FN4O2S/c31-23-10-8-22(9-11-23)30(37)35-19-26(17-28(35)29(36)33-25-14-12-24(32)13-15-25)34(20-27-7-4-16-38-27)18-21-5-2-1-3-6-21/h4,7-11,16,21,24-26,28H,1-3,5-6,12-15,17-20,32H2,(H,33,36)