methyl 2-cyclopropylcarbonylimino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-cyclopropylcarbonylimino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(cyclopropanecarbonylimino)-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[cyclopropyl(oxo)methyl]imino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(cyclopropanecarbonylimino)-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(cyclopropanecarbonylimino)-3-propargyl-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3CC3)S2)CC#C

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3CC3)S2)CC#C

InChI

InChI=1S/C16H14N2O3S/c1-3-8-18-12-7-6-11(15(20)21-2)9-13(12)22-16(18)17-14(19)10-4-5-10/h1,6-7,9-10H,4-5,8H2,2H3