tert-butyl N-[2-[6-(4-fluorophenyl)-3-[(3-pyridin-3-yl-1,3-dihydropyrrolo[1,2-c][1,3]thiazol-7-yl)carbonyl]indol-1-yl]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[6-(4-fluorophenyl)-3-[(3-pyridin-3-yl-1,3-dihydropyrrolo[1,2-c][1,3]thiazol-7-yl)carbonyl]indol-1-yl]ethyl]carbamate Openeye Name: tert-butyl N-[2-[6-(4-fluorophenyl)-3-[3-(3-pyridyl)-1,3-dihydropyrrolo[1,2-c]thiazole-7-carbonyl]indol-1-yl]ethyl]carbamate CAS Name: N-[2-[6-(4-fluorophenyl)-3-[oxo-[3-(3-pyridinyl)-1,3-dihydropyrrolo[1,2-c]thiazol-7-yl]methyl]-1-indolyl]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[6-(4-fluorophenyl)-3-(3-pyridin-3-yl-1,3-dihydropyrrolo[1,2-c][1,3]thiazole-7-carbonyl)indol-1-yl]ethyl]carbamate Traditional Name: N-[2-[6-(4-fluorophenyl)-3-[3-(3-pyridyl)-1,3-dihydropyrrolo[1,2-c]thiazole-7-carbonyl]indol-1-yl]ethyl]carbamic acid tert-butyl ester Formula: C33H31FN4O3S MolecularWeight: 582.687643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCN1C=C(C2=C1C=C(C=C2)C3=CC=C(C=C3)F)C(=O)C4=C5CSC(N5C=C4)C6=CN=CC=C6

Isomeric SMILES

CC(C)(C)OC(=O)NCCN1C=C(C2=C1C=C(C=C2)C3=CC=C(C=C3)F)C(=O)C4=C5CSC(N5C=C4)C6=CN=CC=C6

InChI

InChI=1S/C33H31FN4O3S/c1-33(2,3)41-32(40)36-14-16-37-19-27(25-11-8-22(17-28(25)37)21-6-9-24(34)10-7-21)30(39)26-12-15-38-29(26)20-42-31(38)23-5-4-13-35-18-23/h4-13,15,17-19,31H,14,16,20H2,1-3H3,(H,36,40)