(Z)-3-(4-methoxy-3-oxidanyl-phenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate

Systemtic Name: (Z)-3-(4-methoxy-3-oxidanyl-phenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate Openeye Name: (Z)-3-(3-hydroxy-4-methoxy-phenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate CAS Name: (Z)-3-(3-hydroxy-4-methoxyphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-2-propenoate IUPAC Name: (Z)-3-(3-hydroxy-4-methoxyphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate Traditional Name: (Z)-3-(3-hydroxy-4-methoxy-phenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]acrylate Formula: C13H12N3O4S- MolecularWeight: 306.31708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SC(=CC2=CC(=C(C=C2)OC)O)C(=O)[O-]

Isomeric SMILES

CC1=NC(=NN1)S/C(=C\C2=CC(=C(C=C2)OC)O)/C(=O)[O-]

InChI

InChI=1S/C13H13N3O4S/c1-7-14-13(16-15-7)21-11(12(18)19)6-8-3-4-10(20-2)9(17)5-8/h3-6,17H,1-2H3,(H,18,19)(H,14,15,16)/p-1/b11-6-