3-[1-[[(3,4-dimethoxyphenyl)methyl-methyl-amino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[1-[[(3,4-dimethoxyphenyl)methyl-methyl-amino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[1-[[(3,4-dimethoxyphenyl)methyl-methyl-amino]methyl]-4-methyl-5-thioxo-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[1-[[(3,4-dimethoxyphenyl)methyl-methylamino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[1-[[(3,4-dimethoxyphenyl)methyl-methylamino]methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-methyl-1-[[methyl(veratryl)amino]methyl]-5-thioxo-1,2,4-triazol-3-yl]propionamide Formula: C17H25N5O3S MolecularWeight: 379.4771

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN(C)CC2=CC(=C(C=C2)OC)OC)CCC(=O)N

Isomeric SMILES

CN1C(=NN(C1=S)CN(C)CC2=CC(=C(C=C2)OC)OC)CCC(=O)N

InChI

InChI=1S/C17H25N5O3S/c1-20(10-12-5-6-13(24-3)14(9-12)25-4)11-22-17(26)21(2)16(19-22)8-7-15(18)23/h5-6,9H,7-8,10-11H2,1-4H3,(H2,18,23)