N-[4-(aminomethyl)phenyl]-4-(1,2,4-triazol-1-yl)butanamide

Systemtic Name: N-[4-(aminomethyl)phenyl]-4-(1,2,4-triazol-1-yl)butanamide Openeye Name: N-[4-(aminomethyl)phenyl]-4-(1,2,4-triazol-1-yl)butanamide CAS Name: N-[4-(aminomethyl)phenyl]-4-(1,2,4-triazol-1-yl)butanamide IUPAC Name: N-[4-(aminomethyl)phenyl]-4-(1,2,4-triazol-1-yl)butanamide Traditional Name: N-[4-(aminomethyl)phenyl]-4-(1,2,4-triazol-1-yl)butyramide Formula: C13H17N5O MolecularWeight: 259.30698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN)NC(=O)CCCN2C=NC=N2

Isomeric SMILES

C1=CC(=CC=C1CN)NC(=O)CCCN2C=NC=N2

InChI

InChI=1S/C13H17N5O/c14-8-11-3-5-12(6-4-11)17-13(19)2-1-7-18-10-15-9-16-18/h3-6,9-10H,1-2,7-8,14H2,(H,17,19)