N-(2-chloranyl-4-methyl-phenyl)-2-spiro[1H-quinazoline-2,1'-cyclopentane]-4-ylsulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-4-methyl-phenyl)-2-spiro[1H-quinazoline-2,1'-cyclopentane]-4-ylsulfanyl-ethanamide Openeye Name: N-(2-chloro-4-methyl-phenyl)-2-spiro[1H-quinazoline-2,1'-cyclopentane]-4-ylsulfanyl-acetamide CAS Name: N-(2-chloro-4-methylphenyl)-2-(4-spiro[1H-quinazoline-2,1'-cyclopentane]ylthio)acetamide IUPAC Name: N-(2-chloro-4-methylphenyl)-2-spiro[1H-quinazoline-2,1'-cyclopentane]-4-ylsulfanylacetamide Traditional Name: N-(2-chloro-4-methyl-phenyl)-2-(spiro[1H-quinazoline-2,1'-cyclopentane]-4-ylthio)acetamide Formula: C21H22ClN3OS MolecularWeight: 399.93688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3(CCCC3)NC4=CC=CC=C42)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3(CCCC3)NC4=CC=CC=C42)Cl

InChI

InChI=1S/C21H22ClN3OS/c1-14-8-9-18(16(22)12-14)23-19(26)13-27-20-15-6-2-3-7-17(15)24-21(25-20)10-4-5-11-21/h2-3,6-9,12,24H,4-5,10-11,13H2,1H3,(H,23,26)