2-methyl-N-[(4-propan-2-yl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide

Systemtic Name: 2-methyl-N-[(4-propan-2-yl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide Openeye Name: N-[(5-allylsulfanyl-4-isopropyl-1,2,4-triazol-3-yl)methyl]-2-methyl-benzamide CAS Name: 2-methyl-N-[[4-propan-2-yl-5-(prop-2-enylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 2-methyl-N-[(4-propan-2-yl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide Traditional Name: N-[[5-(allylthio)-4-isopropyl-1,2,4-triazol-3-yl]methyl]-2-methyl-benzamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCC2=NN=C(N2C(C)C)SCC=C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCC2=NN=C(N2C(C)C)SCC=C

InChI

InChI=1S/C17H22N4OS/c1-5-10-23-17-20-19-15(21(17)12(2)3)11-18-16(22)14-9-7-6-8-13(14)4/h5-9,12H,1,10-11H2,2-4H3,(H,18,22)