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

Systemtic Name: ethyl 2-naphthalen-1-ylcarbonylimino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-(naphthalene-1-carbonylimino)-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[1-naphthalenyl(oxo)methyl]imino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(naphthalene-1-carbonylimino)-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(1-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=CC=CC4=CC=CC=C43)S2)CC#C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CC4=CC=CC=C43)S2)CC#C

InChI

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