N-[(2R)-1-[4-(2-fluorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methyl-cyclohexane-1-carboxamide

Systemtic Name: N-[(2R)-1-[4-(2-fluorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methyl-cyclohexane-1-carboxamide Openeye Name: N-[(1R)-1-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-methylsulfanyl-propyl]-4-methyl-cyclohexanecarboxamide CAS Name: N-[(2R)-1-[4-(2-fluorophenyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]-4-methyl-1-cyclohexanecarboxamide IUPAC Name: N-[(2R)-1-[4-(2-fluorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]-4-methylcyclohexane-1-carboxamide Traditional Name: N-[(1R)-1-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-(methylthio)propyl]-4-methyl-cyclohexanecarboxamide Formula: C23H34FN3O2S MolecularWeight: 435.598363

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)NC(CCSC)C(=O)N2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CC1CCC(CC1)C(=O)N[C@H](CCSC)C(=O)N2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C23H34FN3O2S/c1-17-7-9-18(10-8-17)22(28)25-20(11-16-30-2)23(29)27-14-12-26(13-15-27)21-6-4-3-5-19(21)24/h3-6,17-18,20H,7-16H2,1-2H3,(H,25,28)/t17?,18?,20-/m1/s1