methyl (E)-4-oxidanylidene-4-(1,3,4-thiadiazol-2-ylamino)but-2-enoate

Systemtic Name: methyl (E)-4-oxidanylidene-4-(1,3,4-thiadiazol-2-ylamino)but-2-enoate Openeye Name: methyl (E)-4-oxo-4-(1,3,4-thiadiazol-2-ylamino)but-2-enoate CAS Name: (E)-4-oxo-4-(1,3,4-thiadiazol-2-ylamino)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-oxo-4-(1,3,4-thiadiazol-2-ylamino)but-2-enoate Traditional Name: (E)-4-keto-4-(1,3,4-thiadiazol-2-ylamino)but-2-enoic acid methyl ester Formula: C7H7N3O3S MolecularWeight: 213.21378

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(=O)NC1=NN=CS1

Isomeric SMILES

COC(=O)/C=C/C(=O)NC1=NN=CS1

InChI

InChI=1S/C7H7N3O3S/c1-13-6(12)3-2-5(11)9-7-10-8-4-14-7/h2-4H,1H3,(H,9,10,11)/b3-2+