ethyl 3-(2-methoxyethyl)-2-(3,4,5-triethoxyphenyl)carbonylimino-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 3-(2-methoxyethyl)-2-(3,4,5-triethoxyphenyl)carbonylimino-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 3-(2-methoxyethyl)-2-(3,4,5-triethoxybenzoyl)imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-methoxyethyl)-2-[oxo-(3,4,5-triethoxyphenyl)methyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-methoxyethyl)-2-(3,4,5-triethoxybenzoyl)imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-methoxyethyl)-2-(3,4,5-triethoxybenzoyl)imino-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C26H32N2O7S MolecularWeight: 516.60648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N=C2N(C3=C(S2)C=C(C=C3)C(=O)OCC)CCOC

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N=C2N(C3=C(S2)C=C(C=C3)C(=O)OCC)CCOC

InChI

InChI=1S/C26H32N2O7S/c1-6-32-20-14-18(15-21(33-7-2)23(20)34-8-3)24(29)27-26-28(12-13-31-5)19-11-10-17(16-22(19)36-26)25(30)35-9-4/h10-11,14-16H,6-9,12-13H2,1-5H3