tert-butyl 3-(5-thiophen-3-ylpyridin-3-yl)indole-1-carboxylate

Systemtic Name: tert-butyl 3-(5-thiophen-3-ylpyridin-3-yl)indole-1-carboxylate Openeye Name: tert-butyl 3-[5-(3-thienyl)-3-pyridyl]indole-1-carboxylate CAS Name: 3-[5-(3-thiophenyl)-3-pyridinyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(5-thiophen-3-ylpyridin-3-yl)indole-1-carboxylate Traditional Name: 3-[5-(3-thienyl)-3-pyridyl]indole-1-carboxylic acid tert-butyl ester Formula: C22H20N2O2S MolecularWeight: 376.4714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N2O2S/c1-22(2,3)26-21(25)24-13-19(18-6-4-5-7-20(18)24)17-10-16(11-23-12-17)15-8-9-27-14-15/h4-14H,1-3H3