5-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2-methyl-7-prop-2-enyl-quinolin-8-ol

Systemtic Name: 5-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2-methyl-7-prop-2-enyl-quinolin-8-ol Openeye Name: 7-allyl-5-[(2,4-diaminopyrimidin-5-yl)methyl]-2-methyl-quinolin-8-ol CAS Name: 5-[(2,4-diamino-5-pyrimidinyl)methyl]-2-methyl-7-prop-2-enyl-8-quinolinol IUPAC Name: 5-[(2,4-diaminopyrimidin-5-yl)methyl]-2-methyl-7-prop-2-enylquinolin-8-ol Traditional Name: 7-allyl-5-[(2,4-diaminopyrimidin-5-yl)methyl]-2-methyl-quinolin-8-ol Formula: C18H19N5O MolecularWeight: 321.37636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC(=C2O)CC=C)CC3=CN=C(N=C3N)N

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC(=C2O)CC=C)CC3=CN=C(N=C3N)N

InChI

InChI=1S/C18H19N5O/c1-3-4-11-7-12(8-13-9-21-18(20)23-17(13)19)14-6-5-10(2)22-15(14)16(11)24/h3,5-7,9,24H,1,4,8H2,2H3,(H4,19,20,21,23)