3-(1,3-benzodioxol-5-yl)-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-3-phenyl-propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-3-phenyl-propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-3-phenyl-propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-3-phenylpropanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-3-phenylpropanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-3-phenyl-propionamide Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)CNC(=O)CC(C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC(=NN1)CNC(=O)CC(C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N4O3/c1-13-22-19(24-23-13)11-21-20(25)10-16(14-5-3-2-4-6-14)15-7-8-17-18(9-15)27-12-26-17/h2-9,16H,10-12H2,1H3,(H,21,25)(H,22,23,24)