N-[1-[(4-chloranyl-3,5-diethoxy-phenyl)methyl]piperidin-4-yl]-6,7-dimethoxy-4-piperidin-1-yl-quinazolin-2-amine

Systemtic Name: N-[1-[(4-chloranyl-3,5-diethoxy-phenyl)methyl]piperidin-4-yl]-6,7-dimethoxy-4-piperidin-1-yl-quinazolin-2-amine Openeye Name: N-[1-[(4-chloro-3,5-diethoxy-phenyl)methyl]-4-piperidyl]-6,7-dimethoxy-4-(1-piperidyl)quinazolin-2-amine CAS Name: N-[1-[(4-chloro-3,5-diethoxyphenyl)methyl]-4-piperidinyl]-6,7-dimethoxy-4-(1-piperidinyl)-2-quinazolinamine IUPAC Name: N-[1-[(4-chloro-3,5-diethoxyphenyl)methyl]piperidin-4-yl]-6,7-dimethoxy-4-piperidin-1-ylquinazolin-2-amine Traditional Name: [1-(4-chloro-3,5-diethoxy-benzyl)-4-piperidyl]-(6,7-dimethoxy-4-piperidino-quinazolin-2-yl)amine Formula: C31H42ClN5O4 MolecularWeight: 584.14928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1Cl)OCC)CN2CCC(CC2)NC3=NC4=CC(=C(C=C4C(=N3)N5CCCCC5)OC)OC

Isomeric SMILES

CCOC1=CC(=CC(=C1Cl)OCC)CN2CCC(CC2)NC3=NC4=CC(=C(C=C4C(=N3)N5CCCCC5)OC)OC

InChI

InChI=1S/C31H42ClN5O4/c1-5-40-27-16-21(17-28(29(27)32)41-6-2)20-36-14-10-22(11-15-36)33-31-34-24-19-26(39-4)25(38-3)18-23(24)30(35-31)37-12-8-7-9-13-37/h16-19,22H,5-15,20H2,1-4H3,(H,33,34,35)