tert-butyl 3-[oxidanyl-(2-pyridin-3-yl-2,3-dihydro-1,3-thiazol-4-yl)methyl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[oxidanyl-(2-pyridin-3-yl-2,3-dihydro-1,3-thiazol-4-yl)methyl]indole-1-carboxylate Openeye Name: tert-butyl 3-[hydroxy-[2-(3-pyridyl)-2,3-dihydrothiazol-4-yl]methyl]indole-1-carboxylate CAS Name: 3-[hydroxy-[2-(3-pyridinyl)-2,3-dihydrothiazol-4-yl]methyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[hydroxy-(2-pyridin-3-yl-2,3-dihydro-1,3-thiazol-4-yl)methyl]indole-1-carboxylate Traditional Name: 3-[hydroxy-[2-(3-pyridyl)-4-thiazolin-4-yl]methyl]indole-1-carboxylic acid tert-butyl ester Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C(C3=CSC(N3)C4=CN=CC=C4)O

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C(C3=CSC(N3)C4=CN=CC=C4)O

InChI

InChI=1S/C22H23N3O3S/c1-22(2,3)28-21(27)25-12-16(15-8-4-5-9-18(15)25)19(26)17-13-29-20(24-17)14-7-6-10-23-11-14/h4-13,19-20,24,26H,1-3H3