2-(3-cyano-1,2,4-triazol-1-yl)-N-[1-(phenylmethyl)pyrrolidin-3-yl]ethanamide

Systemtic Name: 2-(3-cyano-1,2,4-triazol-1-yl)-N-[1-(phenylmethyl)pyrrolidin-3-yl]ethanamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-2-(3-cyano-1,2,4-triazol-1-yl)acetamide CAS Name: 2-(3-cyano-1,2,4-triazol-1-yl)-N-[1-(phenylmethyl)-3-pyrrolidinyl]acetamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-2-(3-cyano-1,2,4-triazol-1-yl)acetamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-2-(3-cyano-1,2,4-triazol-1-yl)acetamide Formula: C16H18N6O MolecularWeight: 310.35372

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)CN2C=NC(=N2)C#N)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC1NC(=O)CN2C=NC(=N2)C#N)CC3=CC=CC=C3

InChI

InChI=1S/C16H18N6O/c17-8-15-18-12-22(20-15)11-16(23)19-14-6-7-21(10-14)9-13-4-2-1-3-5-13/h1-5,12,14H,6-7,9-11H2,(H,19,23)