N-[(3,4-dimethoxyphenyl)methyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]-N-veratryl-propionamide Formula: C17H24N4O3S MolecularWeight: 364.46246

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SC(C)C(=O)NCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCC1=NC(=NN1)SC(C)C(=O)NCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H24N4O3S/c1-5-6-15-19-17(21-20-15)25-11(2)16(22)18-10-12-7-8-13(23-3)14(9-12)24-4/h7-9,11H,5-6,10H2,1-4H3,(H,18,22)(H,19,20,21)