3-azanyl-5-[3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)amino]propyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-[3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[3-[(1-phenyltetrazol-5-yl)amino]propyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[3-[(1-phenyl-5-tetrazolyl)amino]propyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[3-[(1-phenyltetrazol-5-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[3-[(1-phenyltetrazol-5-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Formula: C14H15N9 MolecularWeight: 309.3292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)NCCCC3=C(C(=NN3)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)NCCCC3=C(C(=NN3)N)C#N

InChI

InChI=1S/C14H15N9/c15-9-11-12(18-19-13(11)16)7-4-8-17-14-20-21-22-23(14)10-5-2-1-3-6-10/h1-3,5-6H,4,7-8H2,(H3,16,18,19)(H,17,20,22)