N-methyl-4-[[methyl-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]amino]methyl]benzamide

Systemtic Name: N-methyl-4-[[methyl-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]amino]methyl]benzamide Openeye Name: N-methyl-4-[[methyl-[[5-(2-thienyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]amino]methyl]benzamide CAS Name: N-methyl-4-[[methyl-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]amino]methyl]benzamide IUPAC Name: N-methyl-4-[[methyl-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]amino]methyl]benzamide Traditional Name: N-methyl-4-[[methyl-[[5-(2-thienyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]amino]methyl]benzamide Formula: C17H19N5OS2 MolecularWeight: 373.49566

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(C)CN2C(=S)N=C(N2)C3=CC=CS3

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(C)CN2C(=S)N=C(N2)C3=CC=CS3

InChI

InChI=1S/C17H19N5OS2/c1-18-16(23)13-7-5-12(6-8-13)10-21(2)11-22-17(24)19-15(20-22)14-4-3-9-25-14/h3-9H,10-11H2,1-2H3,(H,18,23)(H,19,20,24)