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4-[(Z)-(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-6-nitro-phenolate

4-[(Z)-(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-6-nitro-phenolate

Systemtic Name:4-[(Z)-(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-6-nitro-phenolate
Openeye Name:4-[(Z)-(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-6-nitro-phenolate
CAS Name:4-[(Z)-(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-6-nitrophenolate
IUPAC Name:4-[(Z)-(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-6-nitrophenolate
Traditional Name:4-[(Z)-(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-6-nitro-phenolate
Formula: C13H12N5O4S-
MolecularWeight: 334.33048
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=NN2C(=NNC2=S)C3CC3


Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=N\N2C(=NNC2=S)C3CC3


InChI

InChI=1S/C13H13N5O4S/c1-22-10-5-7(4-9(11(10)19)18(20)21)6-14-17-12(8-2-3-8)15-16-13(17)23/h4-6,8,19H,2-3H2,1H3,(H,16,23)/p-1/b14-6-


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