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

Systemtic Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]propanamide Openeye Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]propanamide CAS Name: N-[[5-(2-dimethylaminoethylthio)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]propanamide IUPAC Name: N-[[5-(2-dimethylaminoethylsulfanyl)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]propanamide Traditional Name: N-[[5-(2-dimethylaminoethylthio)-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]propionamide Formula: C17H25N5O2S MolecularWeight: 363.4777

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N5O2S/c1-5-16(23)18-12-15-19-20-17(25-10-9-21(2)3)22(15)13-7-6-8-14(11-13)24-4/h6-8,11H,5,9-10,12H2,1-4H3,(H,18,23)