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

Systemtic Name: 3-(4-methylphenyl)-N-[(5-methylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)methyl]propanamide Openeye Name: N-[(4-allyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-3-(p-tolyl)propanamide CAS Name: 3-(4-methylphenyl)-N-[[5-(methylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]propanamide IUPAC Name: 3-(4-methylphenyl)-N-[(5-methylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)methyl]propanamide Traditional Name: N-[[4-allyl-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-3-(p-tolyl)propionamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(=O)NCC2=NN=C(N2CC=C)SC

Isomeric SMILES

CC1=CC=C(C=C1)CCC(=O)NCC2=NN=C(N2CC=C)SC

InChI

InChI=1S/C17H22N4OS/c1-4-11-21-15(19-20-17(21)23-3)12-18-16(22)10-9-14-7-5-13(2)6-8-14/h4-8H,1,9-12H2,2-3H3,(H,18,22)