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

Systemtic Name: N-[(3-methylphenyl)methylsulfanyl]-N-[4-(3-methylphenyl)-1,2,4-triazol-3-yl]propanamide Openeye Name: N-(m-tolylmethylsulfanyl)-N-[4-(m-tolyl)-1,2,4-triazol-3-yl]propanamide CAS Name: N-[(3-methylphenyl)methylthio]-N-[4-(3-methylphenyl)-1,2,4-triazol-3-yl]propanamide IUPAC Name: N-[(3-methylphenyl)methylsulfanyl]-N-[4-(3-methylphenyl)-1,2,4-triazol-3-yl]propanamide Traditional Name: N-[(3-methylbenzyl)thio]-N-[4-(m-tolyl)-1,2,4-triazol-3-yl]propionamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=NN=CN1C2=CC=CC(=C2)C)SCC3=CC=CC(=C3)C

Isomeric SMILES

CCC(=O)N(C1=NN=CN1C2=CC=CC(=C2)C)SCC3=CC=CC(=C3)C

InChI

InChI=1S/C20H22N4OS/c1-4-19(25)24(26-13-17-9-5-7-15(2)11-17)20-22-21-14-23(20)18-10-6-8-16(3)12-18/h5-12,14H,4,13H2,1-3H3