N-(1-cyclohexylcarbonylpiperidin-4-yl)-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide

Systemtic Name: N-(1-cyclohexylcarbonylpiperidin-4-yl)-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Openeye Name: N-[1-(cyclohexanecarbonyl)-4-piperidyl]-3-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[1-[cyclohexyl(oxo)methyl]-4-piperidinyl]-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-[1-(cyclohexanecarbonyl)-4-piperidyl]-3-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C24H33N5O2S MolecularWeight: 455.61612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NC3CCN(CC3)C(=O)C4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NC3CCN(CC3)C(=O)C4CCCCC4

InChI

InChI=1S/C24H33N5O2S/c1-17-7-9-18(10-8-17)22-26-27-24(32)29(22)16-13-21(30)25-20-11-14-28(15-12-20)23(31)19-5-3-2-4-6-19/h7-10,19-20H,2-6,11-16H2,1H3,(H,25,30)(H,27,32)