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

Systemtic Name: 4-[5-azanyl-3-(hydroxymethyl)-1-propan-2-yl-pyrazol-4-yl]imino-5-(2-hydroxyethylamino)-2-methyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-amino-3-(hydroxymethyl)-1-isopropyl-pyrazol-4-yl]imino-5-(2-hydroxyethylamino)-2-methyl-cyclohexa-2,5-dien-1-one CAS Name: 4-[[5-amino-3-(hydroxymethyl)-1-propan-2-yl-4-pyrazolyl]imino]-5-(2-hydroxyethylamino)-2-methyl-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-amino-3-(hydroxymethyl)-1-propan-2-ylpyrazol-4-yl]imino-5-(2-hydroxyethylamino)-2-methylcyclohexa-2,5-dien-1-one Traditional Name: 4-(5-amino-1-isopropyl-3-methylol-pyrazol-4-yl)imino-5-(2-hydroxyethylamino)-2-methyl-cyclohexa-2,5-dien-1-one Formula: C16H23N5O3 MolecularWeight: 333.38552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N5O3/c1-9(2)21-16(17)15(13(8-23)20-21)19-12-6-10(3)14(24)7-11(12)18-4-5-22/h6-7,9,18,22-23H,4-5,8,17H2,1-3H3