N-[(4-dimethylaminophenyl)methyl]-N-methyl-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-N-methyl-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-N-methyl-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-N-methyl-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-N-methyl-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-[4-(dimethylamino)benzyl]-N-methyl-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN(C)C(=O)C2=CC=C(C=C2)CSC3=NC=NN3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN(C)C(=O)C2=CC=C(C=C2)CSC3=NC=NN3

InChI

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