methyl 4-[(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate

Systemtic Name: methyl 4-[(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate Openeye Name: methyl 4-[(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate CAS Name: 4-[[(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate Traditional Name: 4-[(3-ethyl-4,7-dimethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoic acid methyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2SC1=NC(=O)C3=CC=C(C=C3)C(=O)OC)C)C

Isomeric SMILES

CCN1C2=C(C=CC(=C2SC1=NC(=O)C3=CC=C(C=C3)C(=O)OC)C)C

InChI

InChI=1S/C20H20N2O3S/c1-5-22-16-12(2)6-7-13(3)17(16)26-20(22)21-18(23)14-8-10-15(11-9-14)19(24)25-4/h6-11H,5H2,1-4H3