N-[(4-dimethylaminophenyl)methyl]-N-methyl-3-(5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-N-methyl-3-(5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-N-methyl-3-(5-oxo-3-thioxo-2H-1,2,4-triazin-6-yl)propanamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-N-methyl-3-(5-oxo-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-N-methyl-3-(5-oxo-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanamide Traditional Name: N-[4-(dimethylamino)benzyl]-3-(5-keto-3-thioxo-2H-1,2,4-triazin-6-yl)-N-methyl-propionamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN(C)C(=O)CCC2=NNC(=S)NC2=O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN(C)C(=O)CCC2=NNC(=S)NC2=O

InChI

InChI=1S/C16H21N5O2S/c1-20(2)12-6-4-11(5-7-12)10-21(3)14(22)9-8-13-15(23)17-16(24)19-18-13/h4-7H,8-10H2,1-3H3,(H2,17,19,23,24)