N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[[2-(1-cyclohexenyl)ethylamino]-oxomethyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[2-(cyclohexen-1-yl)ethylcarbamoyl]-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C18H22N6O2S MolecularWeight: 386.47128

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)NC(=O)CSC2=NNC(=N2)C3=CC=NC=C3

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)NC(=O)CSC2=NNC(=N2)C3=CC=NC=C3

InChI

InChI=1S/C18H22N6O2S/c25-15(21-17(26)20-11-6-13-4-2-1-3-5-13)12-27-18-22-16(23-24-18)14-7-9-19-10-8-14/h4,7-10H,1-3,5-6,11-12H2,(H,22,23,24)(H2,20,21,25,26)