(4-methylphenyl) 1-oxidanylidene-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylate

Systemtic Name: (4-methylphenyl) 1-oxidanylidene-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylate Openeye Name: p-tolyl 1-oxo-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylate CAS Name: 1-oxo-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 1-oxo-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylate Traditional Name: 1-keto-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylic acid p-tolyl ester Formula: C18H15NO3S MolecularWeight: 325.3816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)C23CCC(=O)N2C4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)C23CCC(=O)N2C4=CC=CC=C4S3

InChI

InChI=1S/C18H15NO3S/c1-12-6-8-13(9-7-12)22-17(21)18-11-10-16(20)19(18)14-4-2-3-5-15(14)23-18/h2-9H,10-11H2,1H3