ethyl 2-[6-tert-butyl-2-(phenylcarbonylimino)-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-tert-butyl-2-(phenylcarbonylimino)-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-(2-benzoylimino-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(2-benzoylimino-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(2-benzoylimino-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(2-benzoylimino-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)acetic acid ethyl ester Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(CC(CC2)C(C)(C)C)SC1=NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN1C2=C(CC(CC2)C(C)(C)C)SC1=NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H28N2O3S/c1-5-27-19(25)14-24-17-12-11-16(22(2,3)4)13-18(17)28-21(24)23-20(26)15-9-7-6-8-10-15/h6-10,16H,5,11-14H2,1-4H3