6,7-dimethoxy-2-[4-(4-phenanthren-9-ylphenyl)sulfonylpiperazin-1-yl]quinazolin-4-amine hydrochloride

Systemtic Name: 6,7-dimethoxy-2-[4-(4-phenanthren-9-ylphenyl)sulfonylpiperazin-1-yl]quinazolin-4-amine hydrochloride Openeye Name: 6,7-dimethoxy-2-[4-[4-(9-phenanthryl)phenyl]sulfonylpiperazin-1-yl]quinazolin-4-amine hydrochloride CAS Name: 6,7-dimethoxy-2-[4-[4-(9-phenanthrenyl)phenyl]sulfonyl-1-piperazinyl]-4-quinazolinamine hydrochloride IUPAC Name: 6,7-dimethoxy-2-[4-(4-phenanthren-9-ylphenyl)sulfonylpiperazin-1-yl]quinazolin-4-amine hydrochloride Traditional Name: [6,7-dimethoxy-2-[4-[4-(9-phenanthryl)phenyl]sulfonylpiperazino]quinazolin-4-yl]amine hydrochloride Formula: C34H32ClN5O4S MolecularWeight: 642.16698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C5=CC6=CC=CC=C6C7=CC=CC=C75)N)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C5=CC6=CC=CC=C6C7=CC=CC=C75)N)OC.Cl

InChI

InChI=1S/C34H31N5O4S.ClH/c1-42-31-20-29-30(21-32(31)43-2)36-34(37-33(29)35)38-15-17-39(18-16-38)44(40,41)24-13-11-22(12-14-24)28-19-23-7-3-4-8-25(23)26-9-5-6-10-27(26)28;/h3-14,19-21H,15-18H2,1-2H3,(H2,35,36,37);1H