N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-2-methyl-propanamide

Systemtic Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-2-methyl-propanamide Openeye Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-2-methyl-propanamide CAS Name: N-[[5-(2-dimethylaminoethylthio)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-2-methylpropanamide IUPAC Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-2-methylpropanamide Traditional Name: N-[[5-(2-dimethylaminoethylthio)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-2-methyl-propionamide Formula: C18H27N5O2S MolecularWeight: 377.50428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCC1=NN=C(N1C2=CC(=CC=C2)OC)SCCN(C)C

Isomeric SMILES

CC(C)C(=O)NCC1=NN=C(N1C2=CC(=CC=C2)OC)SCCN(C)C

InChI

InChI=1S/C18H27N5O2S/c1-13(2)17(24)19-12-16-20-21-18(26-10-9-22(3)4)23(16)14-7-6-8-15(11-14)25-5/h6-8,11,13H,9-10,12H2,1-5H3,(H,19,24)