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

Systemtic Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]methyl]-3-(4-methylphenyl)propanamide Openeye Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]methyl]-3-(p-tolyl)propanamide CAS Name: N-[[5-(2-dimethylaminoethylthio)-4-methyl-1,2,4-triazol-3-yl]methyl]-3-(4-methylphenyl)propanamide IUPAC Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]methyl]-3-(4-methylphenyl)propanamide Traditional Name: N-[[5-(2-dimethylaminoethylthio)-4-methyl-1,2,4-triazol-3-yl]methyl]-3-(p-tolyl)propionamide Formula: C18H27N5OS MolecularWeight: 361.50488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(=O)NCC2=NN=C(N2C)SCCN(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CCC(=O)NCC2=NN=C(N2C)SCCN(C)C

InChI

InChI=1S/C18H27N5OS/c1-14-5-7-15(8-6-14)9-10-17(24)19-13-16-20-21-18(23(16)4)25-12-11-22(2)3/h5-8H,9-13H2,1-4H3,(H,19,24)