1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]indole-2-carbonitrile

Systemtic Name: 1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]indole-2-carbonitrile Openeye Name: 1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]indole-2-carbonitrile CAS Name: 1-[[2-(4-tert-butyl-2-thiazolyl)-5-benzofuranyl]methyl]-2-indolecarbonitrile IUPAC Name: 1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]indole-2-carbonitrile Traditional Name: 1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]indole-2-carbonitrile Formula: C25H21N3OS MolecularWeight: 411.51874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)CN4C5=CC=CC=C5C=C4C#N

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)CN4C5=CC=CC=C5C=C4C#N

InChI

InChI=1S/C25H21N3OS/c1-25(2,3)23-15-30-24(27-23)22-12-18-10-16(8-9-21(18)29-22)14-28-19(13-26)11-17-6-4-5-7-20(17)28/h4-12,15H,14H2,1-3H3