7-methoxy-3-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)chromen-4-one

Systemtic Name: 7-methoxy-3-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)chromen-4-one Openeye Name: 7-methoxy-3-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)chromen-4-one CAS Name: 7-methoxy-3-phenyl-2-(1H-1,2,4-triazol-5-ylthio)-1-benzopyran-4-one IUPAC Name: 7-methoxy-3-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)chromen-4-one Traditional Name: 7-methoxy-3-phenyl-2-(1H-1,2,4-triazol-5-ylthio)chromone Formula: C18H13N3O3S MolecularWeight: 351.37912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)C(=C(O2)SC3=NC=NN3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)C(=C(O2)SC3=NC=NN3)C4=CC=CC=C4

InChI

InChI=1S/C18H13N3O3S/c1-23-12-7-8-13-14(9-12)24-17(25-18-19-10-20-21-18)15(16(13)22)11-5-3-2-4-6-11/h2-10H,1H3,(H,19,20,21)