methyl 2-[2-(3,5-dimethoxyphenyl)carbonylimino-6-ethyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(3,5-dimethoxyphenyl)carbonylimino-6-ethyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(3,5-dimethoxybenzoyl)imino-6-ethyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[(3,5-dimethoxyphenyl)-oxomethyl]imino-6-ethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3,5-dimethoxybenzoyl)imino-6-ethyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(3,5-dimethoxybenzoyl)imino-6-ethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC(=CC(=C3)OC)OC)S2)CC(=O)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC(=CC(=C3)OC)OC)S2)CC(=O)OC

InChI

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