2-[1-(4,4-diphenylpiperidin-1-yl)-1-oxidanylidene-hexan-2-yl]sulfanyl-3-phenyl-quinazolin-4-one

Systemtic Name: 2-[1-(4,4-diphenylpiperidin-1-yl)-1-oxidanylidene-hexan-2-yl]sulfanyl-3-phenyl-quinazolin-4-one Openeye Name: 2-[1-(4,4-diphenylpiperidine-1-carbonyl)pentylsulfanyl]-3-phenyl-quinazolin-4-one CAS Name: 2-[[1-(4,4-diphenyl-1-piperidinyl)-1-oxohexan-2-yl]thio]-3-phenyl-4-quinazolinone IUPAC Name: 2-[1-(4,4-diphenylpiperidin-1-yl)-1-oxohexan-2-yl]sulfanyl-3-phenylquinazolin-4-one Traditional Name: 2-[1-(4,4-diphenylpiperidine-1-carbonyl)pentylthio]-3-phenyl-quinazolin-4-one Formula: C37H37N3O2S MolecularWeight: 587.77358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)N1CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3)SC4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C6

Isomeric SMILES

CCCCC(C(=O)N1CCC(CC1)(C2=CC=CC=C2)C3=CC=CC=C3)SC4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C6

InChI

InChI=1S/C37H37N3O2S/c1-2-3-23-33(43-36-38-32-22-14-13-21-31(32)34(41)40(36)30-19-11-6-12-20-30)35(42)39-26-24-37(25-27-39,28-15-7-4-8-16-28)29-17-9-5-10-18-29/h4-22,33H,2-3,23-27H2,1H3