4-[5-azanyl-1-tert-butyl-3-(hydroxymethyl)pyrazol-4-yl]imino-5-(2-hydroxyethylamino)-2-methyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-azanyl-1-tert-butyl-3-(hydroxymethyl)pyrazol-4-yl]imino-5-(2-hydroxyethylamino)-2-methyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-amino-1-tert-butyl-3-(hydroxymethyl)pyrazol-4-yl]imino-5-(2-hydroxyethylamino)-2-methyl-cyclohexa-2,5-dien-1-one CAS Name: 4-[[5-amino-1-tert-butyl-3-(hydroxymethyl)-4-pyrazolyl]imino]-5-(2-hydroxyethylamino)-2-methyl-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-amino-1-tert-butyl-3-(hydroxymethyl)pyrazol-4-yl]imino-5-(2-hydroxyethylamino)-2-methylcyclohexa-2,5-dien-1-one Traditional Name: 4-(5-amino-1-tert-butyl-3-methylol-pyrazol-4-yl)imino-5-(2-hydroxyethylamino)-2-methyl-cyclohexa-2,5-dien-1-one Formula: C17H25N5O3 MolecularWeight: 347.4121

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C(N(N=C2CO)C(C)(C)C)N)C(=CC1=O)NCCO

Isomeric SMILES

CC1=CC(=NC2=C(N(N=C2CO)C(C)(C)C)N)C(=CC1=O)NCCO

InChI

InChI=1S/C17H25N5O3/c1-10-7-12(11(8-14(10)25)19-5-6-23)20-15-13(9-24)21-22(16(15)18)17(2,3)4/h7-8,19,23-24H,5-6,9,18H2,1-4H3