N-(2-methylphenyl)-2-spiro[1H-quinazoline-2,1'-cycloheptane]-4-ylsulfanyl-ethanamide

Systemtic Name: N-(2-methylphenyl)-2-spiro[1H-quinazoline-2,1'-cycloheptane]-4-ylsulfanyl-ethanamide Openeye Name: N-(o-tolyl)-2-spiro[1H-quinazoline-2,1'-cycloheptane]-4-ylsulfanyl-acetamide CAS Name: N-(2-methylphenyl)-2-(4-spiro[1H-quinazoline-2,1'-cycloheptane]ylthio)acetamide IUPAC Name: N-(2-methylphenyl)-2-spiro[1H-quinazoline-2,1'-cycloheptane]-4-ylsulfanylacetamide Traditional Name: N-(o-tolyl)-2-(spiro[1H-quinazoline-2,1'-cycloheptane]-4-ylthio)acetamide Formula: C23H27N3OS MolecularWeight: 393.54498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSC2=NC3(CCCCCC3)NC4=CC=CC=C42

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSC2=NC3(CCCCCC3)NC4=CC=CC=C42

InChI

InChI=1S/C23H27N3OS/c1-17-10-4-6-12-19(17)24-21(27)16-28-22-18-11-5-7-13-20(18)25-23(26-22)14-8-2-3-9-15-23/h4-7,10-13,25H,2-3,8-9,14-16H2,1H3,(H,24,27)