ditert-butyl 3-(4-ethoxycarbonyl-1,3-thiazol-2-yl)-3-[(phenylmethylidene)amino]pentanedioate

Systemtic Name: ditert-butyl 3-(4-ethoxycarbonyl-1,3-thiazol-2-yl)-3-[(phenylmethylidene)amino]pentanedioate Openeye Name: ditert-butyl 3-(benzylideneamino)-3-(4-ethoxycarbonylthiazol-2-yl)pentanedioate CAS Name: 3-(4-ethoxycarbonyl-2-thiazolyl)-3-[(phenylmethylene)amino]pentanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 3-(benzylideneamino)-3-(4-ethoxycarbonyl-1,3-thiazol-2-yl)pentanedioate Traditional Name: 3-(benzalamino)-3-(4-carbethoxythiazol-2-yl)glutaric acid ditert-butyl ester Formula: C26H34N2O6S MolecularWeight: 502.62296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)C(CC(=O)OC(C)(C)C)(CC(=O)OC(C)(C)C)N=CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)C(CC(=O)OC(C)(C)C)(CC(=O)OC(C)(C)C)N=CC2=CC=CC=C2

InChI

InChI=1S/C26H34N2O6S/c1-8-32-22(31)19-17-35-23(28-19)26(14-20(29)33-24(2,3)4,15-21(30)34-25(5,6)7)27-16-18-12-10-9-11-13-18/h9-13,16-17H,8,14-15H2,1-7H3