3-[4-methyl-5-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-methyl-5-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-methyl-5-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-methyl-5-[3-(3-methylphenoxy)propylthio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-methyl-5-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-methyl-5-[3-(3-methylphenoxy)propylthio]-1,2,4-triazol-3-yl]propionamide Formula: C16H22N4O2S MolecularWeight: 334.43648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCSC2=NN=C(N2C)CCC(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)OCCCSC2=NN=C(N2C)CCC(=O)N

InChI

InChI=1S/C16H22N4O2S/c1-12-5-3-6-13(11-12)22-9-4-10-23-16-19-18-15(20(16)2)8-7-14(17)21/h3,5-6,11H,4,7-10H2,1-2H3,(H2,17,21)