methyl 5-ethoxy-3-methyl-4-[(3-nitrophenyl)diazenyl]pyrazole-1-carbodithioate

Systemtic Name: methyl 5-ethoxy-3-methyl-4-[(3-nitrophenyl)diazenyl]pyrazole-1-carbodithioate Openeye Name: methyl 5-ethoxy-3-methyl-4-(3-nitrophenyl)azo-pyrazole-1-carbodithioate CAS Name: 5-ethoxy-3-methyl-4-(3-nitrophenyl)azo-1-pyrazolecarbodithioic acid methyl ester IUPAC Name: methyl 5-ethoxy-3-methyl-4-[(3-nitrophenyl)diazenyl]pyrazole-1-carbodithioate Traditional Name: 5-ethoxy-3-methyl-4-(3-nitrophenyl)azo-pyrazole-1-carbodithioic acid methyl ester Formula: C14H15N5O3S2 MolecularWeight: 365.4306

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=NN1C(=S)SC)C)N=NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C(=NN1C(=S)SC)C)N=NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N5O3S2/c1-4-22-13-12(9(2)17-18(13)14(23)24-3)16-15-10-6-5-7-11(8-10)19(20)21/h5-8H,4H2,1-3H3