2-[(2S)-2-azanyl-3-cyclohexyl-propanoyl]-3,4-dihydropyrazole-3-carbonitrile

Systemtic Name: 2-[(2S)-2-azanyl-3-cyclohexyl-propanoyl]-3,4-dihydropyrazole-3-carbonitrile Openeye Name: 2-[(2S)-2-amino-3-cyclohexyl-propanoyl]-3,4-dihydropyrazole-3-carbonitrile CAS Name: 2-[(2S)-2-amino-3-cyclohexyl-1-oxopropyl]-3,4-dihydropyrazole-3-carbonitrile IUPAC Name: 2-[(2S)-2-amino-3-cyclohexylpropanoyl]-3,4-dihydropyrazole-3-carbonitrile Traditional Name: 2-[(2S)-2-amino-3-cyclohexyl-propanoyl]-2-pyrazoline-3-carbonitrile Formula: C13H20N4O MolecularWeight: 248.3241

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)N2C(CC=N2)C#N)N

Isomeric SMILES

C1CCC(CC1)C[C@@H](C(=O)N2C(CC=N2)C#N)N

InChI

InChI=1S/C13H20N4O/c14-9-11-6-7-16-17(11)13(18)12(15)8-10-4-2-1-3-5-10/h7,10-12H,1-6,8,15H2/t11?,12-/m0/s1