2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(1H-1,2,4-triazol-5-yl)ethanimidate

Systemtic Name: 2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(1H-1,2,4-triazol-5-yl)ethanimidate Openeye Name: 2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-N-(1H-1,2,4-triazol-5-yl)ethanimidate CAS Name: 2-[[2-(3-methylanilino)-2-oxoethyl]thio]-N-(1H-1,2,4-triazol-5-yl)ethanimidate IUPAC Name: 2-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-N-(1H-1,2,4-triazol-5-yl)ethanimidate Traditional Name: 2-[[2-keto-2-(m-toluidino)ethyl]thio]-N-(1H-1,2,4-triazol-5-yl)acetimidate Formula: C13H14N5O2S- MolecularWeight: 304.34756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=NC2=NC=NN2)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=NC2=NC=NN2)[O-]

InChI

InChI=1S/C13H15N5O2S/c1-9-3-2-4-10(5-9)16-11(19)6-21-7-12(20)17-13-14-8-15-18-13/h2-5,8H,6-7H2,1H3,(H,16,19)(H2,14,15,17,18,20)/p-1