2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(prop-2-enylcarbamoyl)ethanamide

Systemtic Name: 2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(prop-2-enylcarbamoyl)ethanamide Openeye Name: N-(allylcarbamoyl)-2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-[oxo-(prop-2-enylamino)methyl]acetamide IUPAC Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(prop-2-enylcarbamoyl)acetamide Traditional Name: N-(allylcarbamoyl)-2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C14H22N6O2S MolecularWeight: 338.42848

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)CSC1=NN=C(N1N)C2CCCCC2

Isomeric SMILES

C=CCNC(=O)NC(=O)CSC1=NN=C(N1N)C2CCCCC2

InChI

InChI=1S/C14H22N6O2S/c1-2-8-16-13(22)17-11(21)9-23-14-19-18-12(20(14)15)10-6-4-3-5-7-10/h2,10H,1,3-9,15H2,(H2,16,17,21,22)