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

Systemtic Name: N-cyano-4-[6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-yl]-N'-pyridin-4-yl-piperazine-1-carboximidamide Openeye Name: N-cyano-4-[6-methoxy-7-[3-(1-piperidyl)propoxy]quinazolin-4-yl]-N'-(4-pyridyl)piperazine-1-carboxamidine CAS Name: N-cyano-4-[6-methoxy-7-[3-(1-piperidinyl)propoxy]-4-quinazolinyl]-N'-pyridin-4-yl-1-piperazinecarboximidamide IUPAC Name: N-cyano-4-[6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-yl]-N'-pyridin-4-ylpiperazine-1-carboximidamide Traditional Name: N-cyano-4-[6-methoxy-7-(3-piperidinopropoxy)quinazolin-4-yl]-N'-(4-pyridyl)piperazine-1-carboxamidine Formula: C28H35N9O2 MolecularWeight: 529.6366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=NC4=CC=NC=C4)NC#N)OCCCN5CCCCC5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=NC4=CC=NC=C4)NC#N)OCCCN5CCCCC5

InChI

InChI=1S/C28H35N9O2/c1-38-25-18-23-24(19-26(25)39-17-5-12-35-10-3-2-4-11-35)32-21-33-27(23)36-13-15-37(16-14-36)28(31-20-29)34-22-6-8-30-9-7-22/h6-9,18-19,21H,2-5,10-17H2,1H3,(H,30,31,34)