N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-2-(1,2,4-triazol-1-yl)propanamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-2-(1,2,4-triazol-1-yl)propanamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-2-(1,2,4-triazol-1-yl)propanamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-2-(1,2,4-triazol-1-yl)propanamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-2-(1,2,4-triazol-1-yl)propanamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-2-(1,2,4-triazol-1-yl)propionamide Formula: C18H25N5O MolecularWeight: 327.424

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C(C)N1C=NC=N1)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCC(CNC(=O)C(C)N1C=NC=N1)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C18H25N5O/c1-3-17(10-20-18(24)14(2)23-13-19-12-21-23)22-9-8-15-6-4-5-7-16(15)11-22/h4-7,12-14,17H,3,8-11H2,1-2H3,(H,20,24)