3-[5-[2-[(3-methoxyphenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[5-[2-[(3-methoxyphenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[2-[(3-methoxyphenyl)methyl-methyl-amino]-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[[2-[(3-methoxyphenyl)methyl-methylamino]-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[2-[(3-methoxyphenyl)methyl-methylamino]-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[[2-keto-2-[m-anisyl(methyl)amino]ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C17H23N5O3S MolecularWeight: 377.46122

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)N(C)CC2=CC(=CC=C2)OC)CCC(=O)N

Isomeric SMILES

CN1C(=NN=C1SCC(=O)N(C)CC2=CC(=CC=C2)OC)CCC(=O)N

InChI

InChI=1S/C17H23N5O3S/c1-21(10-12-5-4-6-13(9-12)25-3)16(24)11-26-17-20-19-15(22(17)2)8-7-14(18)23/h4-6,9H,7-8,10-11H2,1-3H3,(H2,18,23)