4-[2-[4-[1H-indol-5-yl-(phenylmethyl)amino]quinazolin-6-yl]ethynyl]-1-methyl-piperidin-4-ol

Systemtic Name: 4-[2-[4-[1H-indol-5-yl-(phenylmethyl)amino]quinazolin-6-yl]ethynyl]-1-methyl-piperidin-4-ol Openeye Name: 4-[2-[4-[benzyl(1H-indol-5-yl)amino]quinazolin-6-yl]ethynyl]-1-methyl-piperidin-4-ol CAS Name: 4-[2-[4-[1H-indol-5-yl-(phenylmethyl)amino]-6-quinazolinyl]ethynyl]-1-methyl-4-piperidinol IUPAC Name: 4-[2-[4-[benzyl(1H-indol-5-yl)amino]quinazolin-6-yl]ethynyl]-1-methylpiperidin-4-ol Traditional Name: 4-[2-[4-[benzyl(1H-indol-5-yl)amino]quinazolin-6-yl]ethynyl]-1-methyl-piperidin-4-ol Formula: C31H29N5O MolecularWeight: 487.59486

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(C#CC2=CC3=C(C=C2)N=CN=C3N(CC4=CC=CC=C4)C5=CC6=C(C=C5)NC=C6)O

Isomeric SMILES

CN1CCC(CC1)(C#CC2=CC3=C(C=C2)N=CN=C3N(CC4=CC=CC=C4)C5=CC6=C(C=C5)NC=C6)O

InChI

InChI=1S/C31H29N5O/c1-35-17-14-31(37,15-18-35)13-11-23-7-9-29-27(19-23)30(34-22-33-29)36(21-24-5-3-2-4-6-24)26-8-10-28-25(20-26)12-16-32-28/h2-10,12,16,19-20,22,32,37H,14-15,17-18,21H2,1H3