4-[6-azanyl-7-(ethylamino)quinazolin-4-yl]-N-(4-phenoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[6-azanyl-7-(ethylamino)quinazolin-4-yl]-N-(4-phenoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-[6-amino-7-(ethylamino)quinazolin-4-yl]-N-(4-phenoxyphenyl)piperazine-1-carboxamide CAS Name: 4-[6-amino-7-(ethylamino)-4-quinazolinyl]-N-(4-phenoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[6-amino-7-(ethylamino)quinazolin-4-yl]-N-(4-phenoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-[6-amino-7-(ethylamino)quinazolin-4-yl]-N-(4-phenoxyphenyl)piperazine-1-carboxamide Formula: C27H29N7O2 MolecularWeight: 483.56486

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)N=CN=C2N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)N

Isomeric SMILES

CCNC1=C(C=C2C(=C1)N=CN=C2N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)N

InChI

InChI=1S/C27H29N7O2/c1-2-29-25-17-24-22(16-23(25)28)26(31-18-30-24)33-12-14-34(15-13-33)27(35)32-19-8-10-21(11-9-19)36-20-6-4-3-5-7-20/h3-11,16-18,29H,2,12-15,28H2,1H3,(H,32,35)