3-[4-[[1-(methylamino)-4-propan-2-yl-2-propyl-cyclohexyl]-(2-oxidanylidenepyrrolidin-3-yl)amino]quinazolin-6-yl]benzenecarbonitrile

Systemtic Name: 3-[4-[[1-(methylamino)-4-propan-2-yl-2-propyl-cyclohexyl]-(2-oxidanylidenepyrrolidin-3-yl)amino]quinazolin-6-yl]benzenecarbonitrile Openeye Name: 3-[4-[[4-isopropyl-1-(methylamino)-2-propyl-cyclohexyl]-(2-oxopyrrolidin-3-yl)amino]quinazolin-6-yl]benzonitrile CAS Name: 3-[4-[[1-(methylamino)-4-propan-2-yl-2-propylcyclohexyl]-(2-oxo-3-pyrrolidinyl)amino]-6-quinazolinyl]benzonitrile IUPAC Name: 3-[4-[[1-(methylamino)-4-propan-2-yl-2-propylcyclohexyl]-(2-oxopyrrolidin-3-yl)amino]quinazolin-6-yl]benzonitrile Traditional Name: 3-[4-[[4-isopropyl-1-(methylamino)-2-propyl-cyclohexyl]-(2-ketopyrrolidin-3-yl)amino]quinazolin-6-yl]benzonitrile Formula: C32H40N6O MolecularWeight: 524.6996

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CC(CCC1(NC)N(C2CCNC2=O)C3=NC=NC4=C3C=C(C=C4)C5=CC=CC(=C5)C#N)C(C)C

Isomeric SMILES

CCCC1CC(CCC1(NC)N(C2CCNC2=O)C3=NC=NC4=C3C=C(C=C4)C5=CC=CC(=C5)C#N)C(C)C

InChI

InChI=1S/C32H40N6O/c1-5-7-26-17-23(21(2)3)12-14-32(26,34-4)38(29-13-15-35-31(29)39)30-27-18-25(10-11-28(27)36-20-37-30)24-9-6-8-22(16-24)19-33/h6,8-11,16,18,20-21,23,26,29,34H,5,7,12-15,17H2,1-4H3,(H,35,39)