N-[4-[[(7-methyl-2-pyrrolidin-1-yl-quinazolin-4-yl)amino]methyl]phenyl]-1-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: N-[4-[[(7-methyl-2-pyrrolidin-1-yl-quinazolin-4-yl)amino]methyl]phenyl]-1-(phenylmethyl)piperidine-4-carboxamide Openeye Name: 1-benzyl-N-[4-[[(7-methyl-2-pyrrolidin-1-yl-quinazolin-4-yl)amino]methyl]phenyl]piperidine-4-carboxamide CAS Name: N-[4-[[[7-methyl-2-(1-pyrrolidinyl)-4-quinazolinyl]amino]methyl]phenyl]-1-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-benzyl-N-[4-[[(7-methyl-2-pyrrolidin-1-ylquinazolin-4-yl)amino]methyl]phenyl]piperidine-4-carboxamide Traditional Name: 1-benzyl-N-[4-[[(7-methyl-2-pyrrolidino-quinazolin-4-yl)amino]methyl]phenyl]isonipecotamide Formula: C33H38N6O MolecularWeight: 534.69442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC3)NCC4=CC=C(C=C4)NC(=O)C5CCN(CC5)CC6=CC=CC=C6

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC3)NCC4=CC=C(C=C4)NC(=O)C5CCN(CC5)CC6=CC=CC=C6

InChI

InChI=1S/C33H38N6O/c1-24-9-14-29-30(21-24)36-33(39-17-5-6-18-39)37-31(29)34-22-25-10-12-28(13-11-25)35-32(40)27-15-19-38(20-16-27)23-26-7-3-2-4-8-26/h2-4,7-14,21,27H,5-6,15-20,22-23H2,1H3,(H,35,40)(H,34,36,37)