methyl (E)-3-[4-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]thiophen-2-yl]-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-[4-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]thiophen-2-yl]-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-[4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-thienyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-thiophenyl]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]thiophen-2-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-thienyl]-2-cyano-acrylic acid methyl ester Formula: C12H10N4O2S3 MolecularWeight: 338.4284

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC(=CS1)CSC2=NN=C(S2)N)C#N

Isomeric SMILES

COC(=O)/C(=C/C1=CC(=CS1)CSC2=NN=C(S2)N)/C#N

InChI

InChI=1S/C12H10N4O2S3/c1-18-10(17)8(4-13)3-9-2-7(5-19-9)6-20-12-16-15-11(14)21-12/h2-3,5H,6H2,1H3,(H2,14,15)/b8-3+