N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-4-(benzotriazol-1-ylmethyl)benzamide

Systemtic Name: N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-4-(benzotriazol-1-ylmethyl)benzamide Openeye Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-4-(benzotriazol-1-ylmethyl)benzamide CAS Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-4-(1-benzotriazolylmethyl)benzamide IUPAC Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-4-(benzotriazol-1-ylmethyl)benzamide Traditional Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-4-(benzotriazol-1-ylmethyl)benzamide Formula: C21H20N8O MolecularWeight: 400.4365

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CC3=CC=C(C=C3)C(=O)NCCCC4=C(C(=NN4)N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CC3=CC=C(C=C3)C(=O)NCCCC4=C(C(=NN4)N)C#N

InChI

InChI=1S/C21H20N8O/c22-12-16-17(25-27-20(16)23)5-3-11-24-21(30)15-9-7-14(8-10-15)13-29-19-6-2-1-4-18(19)26-28-29/h1-2,4,6-10H,3,5,11,13H2,(H,24,30)(H3,23,25,27)