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

Systemtic Name: methyl 4-[(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate Openeye Name: methyl 4-[(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate CAS Name: 4-[[(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoate Traditional Name: 4-[(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)carbamoyl]benzoic acid methyl ester Formula: C18H15BrN2O3S MolecularWeight: 419.2923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15BrN2O3S/c1-3-21-14-9-8-13(19)10-15(14)25-18(21)20-16(22)11-4-6-12(7-5-11)17(23)24-2/h4-10H,3H2,1-2H3