ethyl 2-[2-(4-ethylphenyl)ethanoylimino]-3-methyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[2-(4-ethylphenyl)ethanoylimino]-3-methyl-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[2-(4-ethylphenyl)acetyl]imino-3-methyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[2-(4-ethylphenyl)-1-oxoethyl]imino-3-methyl-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-ethylphenyl)acetyl]imino-3-methyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[2-(4-ethylphenyl)acetyl]imino-3-methyl-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)C(=O)OCC)C

Isomeric SMILES

CCC1=CC=C(C=C1)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)C(=O)OCC)C

InChI

InChI=1S/C21H22N2O3S/c1-4-14-6-8-15(9-7-14)12-19(24)22-21-23(3)17-11-10-16(13-18(17)27-21)20(25)26-5-2/h6-11,13H,4-5,12H2,1-3H3