methyl 4-[(6-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate

Systemtic Name: methyl 4-[(6-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate Openeye Name: methyl 4-[(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate CAS Name: 4-[[(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate Traditional Name: 4-[(6-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoic acid methyl ester Formula: C18H15ClN2O3S MolecularWeight: 374.8413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N(C(=NC(=O)C3=CC=C(C=C3)C(=O)OC)S2)C)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N(C(=NC(=O)C3=CC=C(C=C3)C(=O)OC)S2)C)Cl

InChI

InChI=1S/C18H15ClN2O3S/c1-10-8-13(19)9-14-15(10)21(2)18(25-14)20-16(22)11-4-6-12(7-5-11)17(23)24-3/h4-9H,1-3H3