5-azanyl-1-(2-oxidanyl-6-phenyl-hexan-3-yl)pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(2-oxidanyl-6-phenyl-hexan-3-yl)pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[1-(1-hydroxyethyl)-4-phenyl-butyl]pyrazole-4-carbonitrile CAS Name: 5-amino-1-(2-hydroxy-6-phenylhexan-3-yl)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(2-hydroxy-6-phenylhexan-3-yl)pyrazole-4-carbonitrile Traditional Name: 5-amino-1-[1-(1-hydroxyethyl)-4-phenyl-butyl]pyrazole-4-carbonitrile Formula: C16H20N4O MolecularWeight: 284.3562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCCC1=CC=CC=C1)N2C(=C(C=N2)C#N)N)O

Isomeric SMILES

CC(C(CCCC1=CC=CC=C1)N2C(=C(C=N2)C#N)N)O

InChI

InChI=1S/C16H20N4O/c1-12(21)15(20-16(18)14(10-17)11-19-20)9-5-8-13-6-3-2-4-7-13/h2-4,6-7,11-12,15,21H,5,8-9,18H2,1H3