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

Systemtic Name: N-[3-(dimethylamino)propyl]-3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Openeye Name: N-[3-(dimethylamino)propyl]-3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide CAS Name: N-[3-(dimethylamino)propyl]-3-[[(5-methyl-1H-1,2,4-triazol-3-yl)thio]methyl]benzamide IUPAC Name: N-[3-(dimethylamino)propyl]-3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Traditional Name: N-[3-(dimethylamino)propyl]-3-[[(5-methyl-1H-1,2,4-triazol-3-yl)thio]methyl]benzamide Formula: C16H23N5OS MolecularWeight: 333.45172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SCC2=CC=CC(=C2)C(=O)NCCCN(C)C

Isomeric SMILES

CC1=NC(=NN1)SCC2=CC=CC(=C2)C(=O)NCCCN(C)C

InChI

InChI=1S/C16H23N5OS/c1-12-18-16(20-19-12)23-11-13-6-4-7-14(10-13)15(22)17-8-5-9-21(2)3/h4,6-7,10H,5,8-9,11H2,1-3H3,(H,17,22)(H,18,19,20)