N-[4-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-oxidanylidene-chromen-7-yl]ethanamide

Systemtic Name: N-[4-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-oxidanylidene-chromen-7-yl]ethanamide Openeye Name: N-[4-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-oxo-chromen-7-yl]acetamide CAS Name: N-[4-[[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-2-oxo-1-benzopyran-7-yl]acetamide IUPAC Name: N-[4-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-oxochromen-7-yl]acetamide Traditional Name: N-[4-[[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-2-keto-chromen-7-yl]acetamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SCC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SCC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C

InChI

InChI=1S/C21H24N4O3S/c1-13-23-24-21(25(13)17-6-4-3-5-7-17)29-12-15-10-20(27)28-19-11-16(22-14(2)26)8-9-18(15)19/h8-11,17H,3-7,12H2,1-2H3,(H,22,26)