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

Systemtic Name: ethyl 3-ethyl-2-[2-(4-ethylphenyl)ethanoylimino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 3-ethyl-2-[2-(4-ethylphenyl)acetyl]imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-ethyl-2-[2-(4-ethylphenyl)-1-oxoethyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-ethyl-2-[2-(4-ethylphenyl)acetyl]imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-ethyl-2-[2-(4-ethylphenyl)acetyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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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)CC

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O3S/c1-4-15-7-9-16(10-8-15)13-20(25)23-22-24(5-2)18-12-11-17(14-19(18)28-22)21(26)27-6-3/h7-12,14H,4-6,13H2,1-3H3