2-[4-(4-methylpiperazin-1-yl)-6-(3-phenylpropylamino)-1,3,5-triazin-2-yl]-3,4-dihydro-1H-isoquinolin-6-ol

Systemtic Name: 2-[4-(4-methylpiperazin-1-yl)-6-(3-phenylpropylamino)-1,3,5-triazin-2-yl]-3,4-dihydro-1H-isoquinolin-6-ol Openeye Name: 2-[4-(4-methylpiperazin-1-yl)-6-(3-phenylpropylamino)-1,3,5-triazin-2-yl]-3,4-dihydro-1H-isoquinolin-6-ol CAS Name: 2-[4-(4-methyl-1-piperazinyl)-6-(3-phenylpropylamino)-1,3,5-triazin-2-yl]-3,4-dihydro-1H-isoquinolin-6-ol IUPAC Name: 2-[4-(4-methylpiperazin-1-yl)-6-(3-phenylpropylamino)-1,3,5-triazin-2-yl]-3,4-dihydro-1H-isoquinolin-6-ol Traditional Name: 2-[4-(4-methylpiperazino)-6-(3-phenylpropylamino)-s-triazin-2-yl]-3,4-dihydro-1H-isoquinolin-6-ol Formula: C26H33N7O MolecularWeight: 459.58652

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC(=N2)N3CCC4=C(C3)C=CC(=C4)O)NCCCC5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC(=N2)N3CCC4=C(C3)C=CC(=C4)O)NCCCC5=CC=CC=C5

InChI

InChI=1S/C26H33N7O/c1-31-14-16-32(17-15-31)25-28-24(27-12-5-8-20-6-3-2-4-7-20)29-26(30-25)33-13-11-21-18-23(34)10-9-22(21)19-33/h2-4,6-7,9-10,18,34H,5,8,11-17,19H2,1H3,(H,27,28,29,30)