2-[[4-azanyl-6-[(4-ethoxyphenyl)methyl]-5-oxidanylidene-1,2,4-triazin-3-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[4-azanyl-6-[(4-ethoxyphenyl)methyl]-5-oxidanylidene-1,2,4-triazin-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[4-amino-6-[(4-ethoxyphenyl)methyl]-5-oxo-1,2,4-triazin-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[4-amino-6-[(4-ethoxyphenyl)methyl]-5-oxo-1,2,4-triazin-3-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[4-amino-6-[(4-ethoxyphenyl)methyl]-5-oxo-1,2,4-triazin-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[4-amino-6-(4-ethoxybenzyl)-5-keto-1,2,4-triazin-3-yl]thio]-N-phenyl-acetamide Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=NN=C(N(C2=O)N)SCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=NN=C(N(C2=O)N)SCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H21N5O3S/c1-2-28-16-10-8-14(9-11-16)12-17-19(27)25(21)20(24-23-17)29-13-18(26)22-15-6-4-3-5-7-15/h3-11H,2,12-13,21H2,1H3,(H,22,26)