methyl (E)-3-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate Openeye Name: methyl (E)-3-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate CAS Name: (E)-3-[(4-amino-1,2,4-triazol-3-yl)thio]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate Traditional Name: (E)-3-[(4-amino-1,2,4-triazol-3-yl)thio]acrylic acid methyl ester Formula: C6H8N4O2S MolecularWeight: 200.21832

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CSC1=NN=CN1N

Isomeric SMILES

COC(=O)/C=C/SC1=NN=CN1N

InChI

InChI=1S/C6H8N4O2S/c1-12-5(11)2-3-13-6-9-8-4-10(6)7/h2-4H,7H2,1H3/b3-2+