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

Systemtic Name: 2-methyl-N-[1-[5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: N-[1-[4-allyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]-2-methyl-benzamide CAS Name: 2-methyl-N-[1-[5-[(4-methylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide IUPAC Name: 2-methyl-N-[1-[5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide Traditional Name: N-[1-[4-allyl-5-[(4-methylbenzyl)thio]-1,2,4-triazol-3-yl]ethyl]-2-methyl-benzamide Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)C(C)NC(=O)C3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)C(C)NC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C23H26N4OS/c1-5-14-27-21(18(4)24-22(28)20-9-7-6-8-17(20)3)25-26-23(27)29-15-19-12-10-16(2)11-13-19/h5-13,18H,1,14-15H2,2-4H3,(H,24,28)