N-[2-oxidanylidene-4-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]chromen-7-yl]ethanamide

Systemtic Name: N-[2-oxidanylidene-4-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]chromen-7-yl]ethanamide Openeye Name: N-[2-oxo-4-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]chromen-7-yl]acetamide CAS Name: N-[2-oxo-4-[[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-1-benzopyran-7-yl]acetamide IUPAC Name: N-[2-oxo-4-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]chromen-7-yl]acetamide Traditional Name: N-[2-keto-4-[[[5-(2-thenyl)-1H-1,2,4-triazol-3-yl]thio]methyl]chromen-7-yl]acetamide Formula: C19H16N4O3S2 MolecularWeight: 412.48534

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NNC(=N3)CC4=CC=CS4

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NNC(=N3)CC4=CC=CS4

InChI

InChI=1S/C19H16N4O3S2/c1-11(24)20-13-4-5-15-12(7-18(25)26-16(15)8-13)10-28-19-21-17(22-23-19)9-14-3-2-6-27-14/h2-8H,9-10H2,1H3,(H,20,24)(H,21,22,23)