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

Systemtic Name: 3-[5-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[[2-[(4-dimethylaminophenyl)methyl-methylamino]-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[2-[(4-dimethylaminophenyl)methyl-methylamino]-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[[2-[[4-(dimethylamino)benzyl]-methyl-amino]-2-keto-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C18H26N6O2S MolecularWeight: 390.50304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N6O2S/c1-22(2)14-7-5-13(6-8-14)11-23(3)17(26)12-27-18-21-20-16(24(18)4)10-9-15(19)25/h5-8H,9-12H2,1-4H3,(H2,19,25)