methyl 4-(1,3-benzothiazol-2-ylsulfanyl)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-butanoate

Systemtic Name: methyl 4-(1,3-benzothiazol-2-ylsulfanyl)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-butanoate Openeye Name: methyl 4-(1,3-benzothiazol-2-ylsulfanyl)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-butanoate CAS Name: 4-(1,3-benzothiazol-2-ylthio)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(1,3-benzothiazol-2-ylsulfanyl)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxobutanoate Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-butyric acid methyl ester Formula: C19H15N3O3S2 MolecularWeight: 397.4707

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1NC2=CC=CC=C2N1)C(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC(=O)C(=C1NC2=CC=CC=C2N1)C(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H15N3O3S2/c1-25-18(24)16(17-20-11-6-2-3-7-12(11)21-17)14(23)10-26-19-22-13-8-4-5-9-15(13)27-19/h2-9,20-21H,10H2,1H3