[(3Z)-3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxidanylidene-propyl] 3-methylbut-2-enoate

Systemtic Name: [(3Z)-3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxidanylidene-propyl] 3-methylbut-2-enoate Openeye Name: [(3Z)-3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxo-propyl] 3-methylbut-2-enoate CAS Name: 3-methyl-2-butenoic acid [(3Z)-3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxopropyl] ester IUPAC Name: [(3Z)-3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxopropyl] 3-methylbut-2-enoate Traditional Name: 3-methylbut-2-enoic acid [(3Z)-3-cyano-2-keto-3-(3-methyl-1,3-benzothiazol-2-ylidene)propyl] ester Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OCC(=O)C(=C1N(C2=CC=CC=C2S1)C)C#N)C

Isomeric SMILES

CC(=CC(=O)OCC(=O)/C(=C\1/N(C2=CC=CC=C2S1)C)/C#N)C

InChI

InChI=1S/C17H16N2O3S/c1-11(2)8-16(21)22-10-14(20)12(9-18)17-19(3)13-6-4-5-7-15(13)23-17/h4-8H,10H2,1-3H3/b17-12-