ethyl 3-(2-methoxy-2-oxidanylidene-ethyl)-2-(2-phenoxyphenyl)carbonylimino-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 3-(2-methoxy-2-oxidanylidene-ethyl)-2-(2-phenoxyphenyl)carbonylimino-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 3-(2-methoxy-2-oxo-ethyl)-2-(2-phenoxybenzoyl)imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-methoxy-2-oxoethyl)-2-[oxo-(2-phenoxyphenyl)methyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-methoxy-2-oxoethyl)-2-(2-phenoxybenzoyl)imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-keto-2-methoxy-ethyl)-2-(2-phenoxybenzoyl)imino-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C26H22N2O6S MolecularWeight: 490.52768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CC=C3OC4=CC=CC=C4)S2)CC(=O)OC

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CC=C3OC4=CC=CC=C4)S2)CC(=O)OC

InChI

InChI=1S/C26H22N2O6S/c1-3-33-25(31)17-13-14-20-22(15-17)35-26(28(20)16-23(29)32-2)27-24(30)19-11-7-8-12-21(19)34-18-9-5-4-6-10-18/h4-15H,3,16H2,1-2H3