ethyl 2-naphthalen-2-ylcarbonylimino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-naphthalen-2-ylcarbonylimino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-(naphthalene-2-carbonylimino)-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[2-naphthalenyl(oxo)methyl]imino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(naphthalene-2-carbonylimino)-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(2-naphthoylimino)-3-propargyl-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C24H18N2O3S MolecularWeight: 414.47632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=CC=CC=C4C=C3)S2)CC#C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=CC=CC=C4C=C3)S2)CC#C

InChI

InChI=1S/C24H18N2O3S/c1-3-13-26-20-12-11-19(23(28)29-4-2)15-21(20)30-24(26)25-22(27)18-10-9-16-7-5-6-8-17(16)14-18/h1,5-12,14-15H,4,13H2,2H3