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

Systemtic Name: 2-[4-chloranyl-6-(3-phenylpropylamino)-1,3,5-triazin-2-yl]-3,4-dihydro-1H-isoquinolin-6-ol Openeye Name: 2-[4-chloro-6-(3-phenylpropylamino)-1,3,5-triazin-2-yl]-3,4-dihydro-1H-isoquinolin-6-ol CAS Name: 2-[4-chloro-6-(3-phenylpropylamino)-1,3,5-triazin-2-yl]-3,4-dihydro-1H-isoquinolin-6-ol IUPAC Name: 2-[4-chloro-6-(3-phenylpropylamino)-1,3,5-triazin-2-yl]-3,4-dihydro-1H-isoquinolin-6-ol Traditional Name: 2-[4-chloro-6-(3-phenylpropylamino)-s-triazin-2-yl]-3,4-dihydro-1H-isoquinolin-6-ol Formula: C21H22ClN5O MolecularWeight: 395.88528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=C(C=C2)O)C3=NC(=NC(=N3)Cl)NCCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=C1C=C(C=C2)O)C3=NC(=NC(=N3)Cl)NCCCC4=CC=CC=C4

InChI

InChI=1S/C21H22ClN5O/c22-19-24-20(23-11-4-7-15-5-2-1-3-6-15)26-21(25-19)27-12-10-16-13-18(28)9-8-17(16)14-27/h1-3,5-6,8-9,13,28H,4,7,10-12,14H2,(H,23,24,25,26)