ethyl 2-[2-[3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxidanylidene-propyl]sulfanyl-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxidanylidene-propyl]sulfanyl-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxo-propyl]sulfanylthiazol-4-yl]acetate CAS Name: 2-[2-[[3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxopropyl]thio]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[3-cyano-3-(3-methyl-1,3-benzothiazol-2-ylidene)-2-oxopropyl]sulfanyl-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[3-cyano-2-keto-3-(3-methyl-1,3-benzothiazol-2-ylidene)propyl]thio]thiazol-4-yl]acetic acid ethyl ester Formula: C19H17N3O3S3 MolecularWeight: 431.55158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)SCC(=O)C(=C2N(C3=CC=CC=C3S2)C)C#N

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)SCC(=O)C(=C2N(C3=CC=CC=C3S2)C)C#N

InChI

InChI=1S/C19H17N3O3S3/c1-3-25-17(24)8-12-10-26-19(21-12)27-11-15(23)13(9-20)18-22(2)14-6-4-5-7-16(14)28-18/h4-7,10H,3,8,11H2,1-2H3