3-cyclopentyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-cyclopentyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-cyclopentyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-cyclopentyl-2-[(3-methyl-2-quinoxalinyl)methylthio]-4-quinazolinone IUPAC Name: 3-cyclopentyl-2-[(3-methylquinoxalin-2-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-cyclopentyl-2-[(3-methylquinoxalin-2-yl)methylthio]quinazolin-4-one Formula: C23H22N4OS MolecularWeight: 402.51198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1CSC3=NC4=CC=CC=C4C(=O)N3C5CCCC5

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1CSC3=NC4=CC=CC=C4C(=O)N3C5CCCC5

InChI

InChI=1S/C23H22N4OS/c1-15-21(25-20-13-7-6-12-19(20)24-15)14-29-23-26-18-11-5-4-10-17(18)22(28)27(23)16-8-2-3-9-16/h4-7,10-13,16H,2-3,8-9,14H2,1H3