methyl (E)-4,4-dicyano-4-(thiophen-3-ylmethylideneamino)but-2-enoate

Systemtic Name: methyl (E)-4,4-dicyano-4-(thiophen-3-ylmethylideneamino)but-2-enoate Openeye Name: methyl (E)-4,4-dicyano-4-(3-thienylmethyleneamino)but-2-enoate CAS Name: (E)-4,4-dicyano-4-(3-thiophenylmethylideneamino)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4,4-dicyano-4-(thiophen-3-ylmethylideneamino)but-2-enoate Traditional Name: (E)-4,4-dicyano-4-(3-thenylideneamino)but-2-enoic acid methyl ester Formula: C12H9N3O2S MolecularWeight: 259.28376

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(C#N)(C#N)N=CC1=CSC=C1

Isomeric SMILES

COC(=O)/C=C/C(C#N)(C#N)N=CC1=CSC=C1

InChI

InChI=1S/C12H9N3O2S/c1-17-11(16)2-4-12(8-13,9-14)15-6-10-3-5-18-7-10/h2-7H,1H3/b4-2+,15-6?