methyl 2-[2-(4-methylphenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(4-methylphenyl)carbonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(4-methylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(4-methylphenyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(4-methylbenzoyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(2-p-toluoylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N=C2N(C3=CC=CC=C3S2)CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N=C2N(C3=CC=CC=C3S2)CC(=O)OC

InChI

InChI=1S/C18H16N2O3S/c1-12-7-9-13(10-8-12)17(22)19-18-20(11-16(21)23-2)14-5-3-4-6-15(14)24-18/h3-10H,11H2,1-2H3