3-[(2-phenyl-1,2,3-triazol-4-yl)methylamino]propanamide

Systemtic Name: 3-[(2-phenyl-1,2,3-triazol-4-yl)methylamino]propanamide Openeye Name: 3-[(2-phenyltriazol-4-yl)methylamino]propanamide CAS Name: 3-[(2-phenyl-4-triazolyl)methylamino]propanamide IUPAC Name: 3-[(2-phenyltriazol-4-yl)methylamino]propanamide Traditional Name: 3-[(2-phenyltriazol-4-yl)methylamino]propionamide Formula: C12H15N5O MolecularWeight: 245.2804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=CC(=N2)CNCCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)N2N=CC(=N2)CNCCC(=O)N

InChI

InChI=1S/C12H15N5O/c13-12(18)6-7-14-8-10-9-15-17(16-10)11-4-2-1-3-5-11/h1-5,9,14H,6-8H2,(H2,13,18)