4-(dimethylamino)-N-[[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 4-(dimethylamino)-N-[[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: N-[(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-4-(dimethylamino)benzamide CAS Name: 4-(dimethylamino)-N-[[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: N-[(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-4-(dimethylamino)benzamide Traditional Name: N-[[5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]methyl]-4-(dimethylamino)benzamide Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2)CNC(=O)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2)CNC(=O)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C20H23N5OS/c1-24(2)17-11-9-16(10-12-17)19(26)21-13-18-22-23-20(25(18)3)27-14-15-7-5-4-6-8-15/h4-12H,13-14H2,1-3H3,(H,21,26)