N-cyano-4-[6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-yl]-N'-(4-pyridin-2-ylphenyl)piperazine-1-carboximidamide

Systemtic Name: N-cyano-4-[6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-yl]-N'-(4-pyridin-2-ylphenyl)piperazine-1-carboximidamide Openeye Name: N-cyano-4-[6-methoxy-7-[3-(1-piperidyl)propoxy]quinazolin-4-yl]-N'-[4-(2-pyridyl)phenyl]piperazine-1-carboxamidine CAS Name: N-cyano-4-[6-methoxy-7-[3-(1-piperidinyl)propoxy]-4-quinazolinyl]-N'-[4-(2-pyridinyl)phenyl]-1-piperazinecarboximidamide IUPAC Name: N-cyano-4-[6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-yl]-N'-(4-pyridin-2-ylphenyl)piperazine-1-carboximidamide Traditional Name: N-cyano-4-[6-methoxy-7-(3-piperidinopropoxy)quinazolin-4-yl]-N'-[4-(2-pyridyl)phenyl]piperazine-1-carboxamidine Formula: C34H39N9O2 MolecularWeight: 605.73256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=NC4=CC=C(C=C4)C5=CC=CC=N5)NC#N)OCCCN6CCCCC6

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=NC4=CC=C(C=C4)C5=CC=CC=N5)NC#N)OCCCN6CCCCC6

InChI

InChI=1S/C34H39N9O2/c1-44-31-22-28-30(23-32(31)45-21-7-16-41-14-5-2-6-15-41)38-25-39-33(28)42-17-19-43(20-18-42)34(37-24-35)40-27-11-9-26(10-12-27)29-8-3-4-13-36-29/h3-4,8-13,22-23,25H,2,5-7,14-21H2,1H3,(H,37,40)