methyl 2-[2-(2,6-dimethoxyphenyl)carbonylimino-4,6-dimethyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(2,6-dimethoxyphenyl)carbonylimino-4,6-dimethyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(2,6-dimethoxybenzoyl)imino-4,6-dimethyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(2,6-dimethoxyphenyl)-oxomethyl]imino-4,6-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(2,6-dimethoxybenzoyl)imino-4,6-dimethyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(2,6-dimethoxybenzoyl)imino-4,6-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=NC(=O)C3=C(C=CC=C3OC)OC)N2CC(=O)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=NC(=O)C3=C(C=CC=C3OC)OC)N2CC(=O)OC)C

InChI

InChI=1S/C21H22N2O5S/c1-12-9-13(2)19-16(10-12)29-21(23(19)11-17(24)28-5)22-20(25)18-14(26-3)7-6-8-15(18)27-4/h6-10H,11H2,1-5H3