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

Systemtic Name: methyl 4-[(3-ethyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate Openeye Name: methyl 4-[(3-ethyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate CAS Name: 4-[[[3-ethyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-ethyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate Traditional Name: 4-[[3-ethyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]carbamoyl]benzoic acid methyl ester Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H18N2O3S2/c1-4-21-15-10-9-14(25-3)11-16(15)26-19(21)20-17(22)12-5-7-13(8-6-12)18(23)24-2/h5-11H,4H2,1-3H3