5-azanyl-4-[5-azanyl-1-(phenylmethyl)pyrazol-4-yl]imino-2-methyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 5-azanyl-4-[5-azanyl-1-(phenylmethyl)pyrazol-4-yl]imino-2-methyl-cyclohexa-2,5-dien-1-one Openeye Name: 5-amino-4-(5-amino-1-benzyl-pyrazol-4-yl)imino-2-methyl-cyclohexa-2,5-dien-1-one CAS Name: 5-amino-4-[[5-amino-1-(phenylmethyl)-4-pyrazolyl]imino]-2-methyl-1-cyclohexa-2,5-dienone IUPAC Name: 5-amino-4-(5-amino-1-benzylpyrazol-4-yl)imino-2-methylcyclohexa-2,5-dien-1-one Traditional Name: 5-amino-4-(5-amino-1-benzyl-pyrazol-4-yl)imino-2-methyl-cyclohexa-2,5-dien-1-one Formula: C17H17N5O MolecularWeight: 307.34978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C(N(N=C2)CC3=CC=CC=C3)N)C(=CC1=O)N

Isomeric SMILES

CC1=CC(=NC2=C(N(N=C2)CC3=CC=CC=C3)N)C(=CC1=O)N

InChI

InChI=1S/C17H17N5O/c1-11-7-14(13(18)8-16(11)23)21-15-9-20-22(17(15)19)10-12-5-3-2-4-6-12/h2-9H,10,18-19H2,1H3