8-propan-2-yl-2-[[4-(4-pyrrolidin-2-ylcarbonylpiperazin-1-yl)phenyl]amino]-1H-quinazolin-7-one

Systemtic Name: 8-propan-2-yl-2-[[4-(4-pyrrolidin-2-ylcarbonylpiperazin-1-yl)phenyl]amino]-1H-quinazolin-7-one Openeye Name: 8-isopropyl-2-[4-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]anilino]-1H-quinazolin-7-one CAS Name: 2-[4-[4-[oxo(2-pyrrolidinyl)methyl]-1-piperazinyl]anilino]-8-propan-2-yl-1H-quinazolin-7-one IUPAC Name: 8-propan-2-yl-2-[4-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]anilino]-1H-quinazolin-7-one Traditional Name: 8-isopropyl-2-[4-(4-prolylpiperazino)anilino]-1H-quinazolin-7-one Formula: C26H32N6O2 MolecularWeight: 460.57128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CN=C(N2)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C5CCCN5)C=CC1=O

Isomeric SMILES

CC(C)C1=C2C(=CN=C(N2)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C5CCCN5)C=CC1=O

InChI

InChI=1S/C26H32N6O2/c1-17(2)23-22(33)10-5-18-16-28-26(30-24(18)23)29-19-6-8-20(9-7-19)31-12-14-32(15-13-31)25(34)21-4-3-11-27-21/h5-10,16-17,21,27H,3-4,11-15H2,1-2H3,(H2,28,29,30)