1-(4-methyl-2-oxidanylidene-chromen-7-yl)-3-(1,2,4-triazol-4-yl)thiourea

Systemtic Name: 1-(4-methyl-2-oxidanylidene-chromen-7-yl)-3-(1,2,4-triazol-4-yl)thiourea Openeye Name: 1-(4-methyl-2-oxo-chromen-7-yl)-3-(1,2,4-triazol-4-yl)thiourea CAS Name: 1-(4-methyl-2-oxo-1-benzopyran-7-yl)-3-(1,2,4-triazol-4-yl)thiourea IUPAC Name: 1-(4-methyl-2-oxochromen-7-yl)-3-(1,2,4-triazol-4-yl)thiourea Traditional Name: 1-(2-keto-4-methyl-chromen-7-yl)-3-(1,2,4-triazol-4-yl)thiourea Formula: C13H11N5O2S MolecularWeight: 301.32374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NN3C=NN=C3

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NN3C=NN=C3

InChI

InChI=1S/C13H11N5O2S/c1-8-4-12(19)20-11-5-9(2-3-10(8)11)16-13(21)17-18-6-14-15-7-18/h2-7H,1H3,(H2,16,17,21)