tert-butyl 3-[(2-oxidanylidene-3-pyridin-3-yl-1,3-dihydropyrrolo[1,2-c][1,3]thiazol-7-yl)carbonyl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[(2-oxidanylidene-3-pyridin-3-yl-1,3-dihydropyrrolo[1,2-c][1,3]thiazol-7-yl)carbonyl]indole-1-carboxylate Openeye Name: tert-butyl 3-[2-oxo-3-(3-pyridyl)-1,3-dihydropyrrolo[1,2-c]thiazole-7-carbonyl]indole-1-carboxylate CAS Name: 3-[oxo-[2-oxo-3-(3-pyridinyl)-1,3-dihydropyrrolo[1,2-c]thiazol-7-yl]methyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-oxo-3-pyridin-3-yl-1,3-dihydropyrrolo[1,2-c][1,3]thiazole-7-carbonyl)indole-1-carboxylate Traditional Name: 3-[2-keto-3-(3-pyridyl)-1,3-dihydropyrrolo[1,2-c]thiazole-7-carbonyl]indole-1-carboxylic acid tert-butyl ester Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C(=O)C3=C4CS(=O)C(N4C=C3)C5=CN=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C(=O)C3=C4CS(=O)C(N4C=C3)C5=CN=CC=C5

InChI

InChI=1S/C25H23N3O4S/c1-25(2,3)32-24(30)28-14-19(17-8-4-5-9-20(17)28)22(29)18-10-12-27-21(18)15-33(31)23(27)16-7-6-11-26-13-16/h4-14,23H,15H2,1-3H3