N-[(3,5-dimethoxyphenyl)methyl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(3,5-dimethoxyphenyl)methyl]acetamide CAS Name: N-[(3,5-dimethoxyphenyl)methyl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(3,5-dimethoxyphenyl)methyl]-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(3,5-dimethoxybenzyl)acetamide Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SCC(=O)NCC2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CC1=NN=C(N1CC=C)SCC(=O)NCC2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C17H22N4O3S/c1-5-6-21-12(2)19-20-17(21)25-11-16(22)18-10-13-7-14(23-3)9-15(8-13)24-4/h5,7-9H,1,6,10-11H2,2-4H3,(H,18,22)