4-[(4-oxidanylidenethieno[3,2-d][1,2,3]triazin-3-yl)methyl]-N-phenethyl-benzamide

Systemtic Name: 4-[(4-oxidanylidenethieno[3,2-d][1,2,3]triazin-3-yl)methyl]-N-phenethyl-benzamide Openeye Name: 4-[(4-oxothieno[3,2-d]triazin-3-yl)methyl]-N-phenethyl-benzamide CAS Name: 4-[(4-oxo-3-thieno[3,2-d]triazinyl)methyl]-N-phenethylbenzamide IUPAC Name: 4-[(4-oxothieno[3,2-d]triazin-3-yl)methyl]-N-phenethylbenzamide Traditional Name: 4-[(4-ketothieno[3,2-d]triazin-3-yl)methyl]-N-phenethyl-benzamide Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)CN3C(=O)C4=C(C=CS4)N=N3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)CN3C(=O)C4=C(C=CS4)N=N3

InChI

InChI=1S/C21H18N4O2S/c26-20(22-12-10-15-4-2-1-3-5-15)17-8-6-16(7-9-17)14-25-21(27)19-18(23-24-25)11-13-28-19/h1-9,11,13H,10,12,14H2,(H,22,26)