1-[3-[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]propyl]-6-methyl-indole-3-carbonitrile

Systemtic Name: 1-[3-[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]propyl]-6-methyl-indole-3-carbonitrile Openeye Name: 1-[3-[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]propyl]-6-methyl-indole-3-carbonitrile CAS Name: 1-[3-[2-(4-tert-butyl-2-thiazolyl)-5-benzofuranyl]propyl]-6-methyl-3-indolecarbonitrile IUPAC Name: 1-[3-[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]propyl]-6-methylindole-3-carbonitrile Traditional Name: 1-[3-[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]propyl]-6-methyl-indole-3-carbonitrile Formula: C28H27N3OS MolecularWeight: 453.59848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CN2CCCC3=CC4=C(C=C3)OC(=C4)C5=NC(=CS5)C(C)(C)C)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CN2CCCC3=CC4=C(C=C3)OC(=C4)C5=NC(=CS5)C(C)(C)C)C#N

InChI

InChI=1S/C28H27N3OS/c1-18-7-9-22-21(15-29)16-31(23(22)12-18)11-5-6-19-8-10-24-20(13-19)14-25(32-24)27-30-26(17-33-27)28(2,3)4/h7-10,12-14,16-17H,5-6,11H2,1-4H3