ethyl 2-[2-[2-(4-ethylphenyl)ethanoylimino]-6-methyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(4-ethylphenyl)ethanoylimino]-6-methyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(4-ethylphenyl)acetyl]imino-6-methyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[2-(4-ethylphenyl)-1-oxoethyl]imino-6-methyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(4-ethylphenyl)acetyl]imino-6-methyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[2-(4-ethylphenyl)acetyl]imino-6-methyl-1,3-benzothiazol-3-yl]acetic 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)CC(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O3S/c1-4-16-7-9-17(10-8-16)13-20(25)23-22-24(14-21(26)27-5-2)18-11-6-15(3)12-19(18)28-22/h6-12H,4-5,13-14H2,1-3H3