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

Systemtic Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(3,4-dimethoxyphenyl)methyl]propanamide Openeye Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(3,4-dimethoxyphenyl)methyl]propanamide CAS Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-N-[(3,4-dimethoxyphenyl)methyl]propanamide IUPAC Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(3,4-dimethoxyphenyl)methyl]propanamide Traditional Name: 2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-N-veratryl-propionamide Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)SC2=NNC(=N2)C3CC3

Isomeric SMILES

CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)SC2=NNC(=N2)C3CC3

InChI

InChI=1S/C17H22N4O3S/c1-10(25-17-19-15(20-21-17)12-5-6-12)16(22)18-9-11-4-7-13(23-2)14(8-11)24-3/h4,7-8,10,12H,5-6,9H2,1-3H3,(H,18,22)(H,19,20,21)