tert-butyl N-methyl-N-[[1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-yl]methyl]carbamate

Systemtic Name: tert-butyl N-methyl-N-[[1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-yl]methyl]carbamate Openeye Name: tert-butyl N-methyl-N-[[1-[2-(3-pyridyl)quinazolin-4-yl]-3-piperidyl]methyl]carbamate CAS Name: N-methyl-N-[[1-[2-(3-pyridinyl)-4-quinazolinyl]-3-piperidinyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-methyl-N-[[1-(2-pyridin-3-ylquinazolin-4-yl)piperidin-3-yl]methyl]carbamate Traditional Name: N-methyl-N-[[1-[2-(3-pyridyl)quinazolin-4-yl]-3-piperidyl]methyl]carbamic acid tert-butyl ester Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)CC1CCCN(C1)C2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N(C)CC1CCCN(C1)C2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4

InChI

InChI=1S/C25H31N5O2/c1-25(2,3)32-24(31)29(4)16-18-9-8-14-30(17-18)23-20-11-5-6-12-21(20)27-22(28-23)19-10-7-13-26-15-19/h5-7,10-13,15,18H,8-9,14,16-17H2,1-4H3