[4-[cyclohexylmethyl(thiophen-2-ylmethyl)amino]-1-(4-fluorophenyl)carbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone

Systemtic Name: [4-[cyclohexylmethyl(thiophen-2-ylmethyl)amino]-1-(4-fluorophenyl)carbonyl-pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [4-[cyclohexylmethyl(2-thienylmethyl)amino]-1-(4-fluorobenzoyl)pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[cyclohexylmethyl(thiophen-2-ylmethyl)amino]-1-[(4-fluorophenyl)-oxomethyl]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [4-[cyclohexylmethyl(thiophen-2-ylmethyl)amino]-1-(4-fluorobenzoyl)pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [4-[cyclohexylmethyl(2-thenyl)amino]-1-(4-fluorobenzoyl)pyrrolidin-2-yl]-piperazino-methanone Formula: C28H37FN4O2S MolecularWeight: 512.682383

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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)N5CCNCC5

Isomeric SMILES

C1CCC(CC1)CN(CC2=CC=CS2)C3CC(N(C3)C(=O)C4=CC=C(C=C4)F)C(=O)N5CCNCC5

InChI

InChI=1S/C28H37FN4O2S/c29-23-10-8-22(9-11-23)27(34)33-19-24(17-26(33)28(35)31-14-12-30-13-15-31)32(20-25-7-4-16-36-25)18-21-5-2-1-3-6-21/h4,7-11,16,21,24,26,30H,1-3,5-6,12-15,17-20H2