N-[2-oxidanylidene-4-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]chromen-7-yl]ethanamide

Systemtic Name: N-[2-oxidanylidene-4-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]chromen-7-yl]ethanamide Openeye Name: N-[4-[(4-allyl-1,2,4-triazol-3-yl)sulfanylmethyl]-2-oxo-chromen-7-yl]acetamide CAS Name: N-[2-oxo-4-[[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methyl]-1-benzopyran-7-yl]acetamide IUPAC Name: N-[2-oxo-4-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]chromen-7-yl]acetamide Traditional Name: N-[4-[[(4-allyl-1,2,4-triazol-3-yl)thio]methyl]-2-keto-chromen-7-yl]acetamide Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=CN3CC=C

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=CN3CC=C

InChI

InChI=1S/C17H16N4O3S/c1-3-6-21-10-18-20-17(21)25-9-12-7-16(23)24-15-8-13(19-11(2)22)4-5-14(12)15/h3-5,7-8,10H,1,6,9H2,2H3,(H,19,22)