N-methyl-4-[[methyl-[(4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]methyl]benzamide

Systemtic Name: N-methyl-4-[[methyl-[(4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]methyl]benzamide Openeye Name: 4-[[(4-allyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-amino]methyl]-N-methyl-benzamide CAS Name: N-methyl-4-[[methyl-[(4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]methyl]benzamide IUPAC Name: N-methyl-4-[[methyl-[(4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]amino]methyl]benzamide Traditional Name: 4-[[(4-allyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-amino]methyl]-N-methyl-benzamide Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N5OS/c1-4-9-20-11-18-21(16(20)23)12-19(3)10-13-5-7-14(8-6-13)15(22)17-2/h4-8,11H,1,9-10,12H2,2-3H3,(H,17,22)