2-[4-(2-chloranylpyrimidin-4-yl)piperazin-1-yl]-6,7-dimethoxy-quinazolin-4-amine

Systemtic Name: 2-[4-(2-chloranylpyrimidin-4-yl)piperazin-1-yl]-6,7-dimethoxy-quinazolin-4-amine Openeye Name: 2-[4-(2-chloropyrimidin-4-yl)piperazin-1-yl]-6,7-dimethoxy-quinazolin-4-amine CAS Name: 2-[4-(2-chloro-4-pyrimidinyl)-1-piperazinyl]-6,7-dimethoxy-4-quinazolinamine IUPAC Name: 2-[4-(2-chloropyrimidin-4-yl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine Traditional Name: [2-[4-(2-chloropyrimidin-4-yl)piperazino]-6,7-dimethoxy-quinazolin-4-yl]amine Formula: C18H20ClN7O2 MolecularWeight: 401.8501

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C4=NC(=NC=C4)Cl)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C4=NC(=NC=C4)Cl)N)OC

InChI

InChI=1S/C18H20ClN7O2/c1-27-13-9-11-12(10-14(13)28-2)22-18(24-16(11)20)26-7-5-25(6-8-26)15-3-4-21-17(19)23-15/h3-4,9-10H,5-8H2,1-2H3,(H2,20,22,24)