3-azanyl-2-(phenylmethyl)-4-[(phenylmethyl)amino]-1H-pyrazol-5-one

Systemtic Name: 3-azanyl-2-(phenylmethyl)-4-[(phenylmethyl)amino]-1H-pyrazol-5-one Openeye Name: 3-amino-2-benzyl-4-(benzylamino)-1H-pyrazol-5-one CAS Name: 3-amino-2-(phenylmethyl)-4-[(phenylmethyl)amino]-1H-pyrazol-5-one IUPAC Name: 3-amino-2-benzyl-4-(benzylamino)-1H-pyrazol-5-one Traditional Name: 5-amino-1-benzyl-4-(benzylamino)-3-pyrazolin-3-one Formula: C17H18N4O MolecularWeight: 294.35102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(N(NC2=O)CC3=CC=CC=C3)N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(N(NC2=O)CC3=CC=CC=C3)N

InChI

InChI=1S/C17H18N4O/c18-16-15(19-11-13-7-3-1-4-8-13)17(22)20-21(16)12-14-9-5-2-6-10-14/h1-10,19H,11-12,18H2,(H,20,22)