3-[5-oxidanylidene-3-(4-phenylmethoxyphenyl)-2H-1,2,4-triazin-6-yl]-N-(2-thiophen-2-ylethyl)propanamide

Systemtic Name: 3-[5-oxidanylidene-3-(4-phenylmethoxyphenyl)-2H-1,2,4-triazin-6-yl]-N-(2-thiophen-2-ylethyl)propanamide Openeye Name: 3-[3-(4-benzyloxyphenyl)-5-oxo-2H-1,2,4-triazin-6-yl]-N-[2-(2-thienyl)ethyl]propanamide CAS Name: 3-[5-oxo-3-(4-phenylmethoxyphenyl)-2H-1,2,4-triazin-6-yl]-N-(2-thiophen-2-ylethyl)propanamide IUPAC Name: 3-[5-oxo-3-(4-phenylmethoxyphenyl)-2H-1,2,4-triazin-6-yl]-N-(2-thiophen-2-ylethyl)propanamide Traditional Name: 3-[3-(4-benzoxyphenyl)-5-keto-2H-1,2,4-triazin-6-yl]-N-[2-(2-thienyl)ethyl]propionamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC(=O)C(=NN3)CCC(=O)NCCC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC(=O)C(=NN3)CCC(=O)NCCC4=CC=CS4

InChI

InChI=1S/C25H24N4O3S/c30-23(26-15-14-21-7-4-16-33-21)13-12-22-25(31)27-24(29-28-22)19-8-10-20(11-9-19)32-17-18-5-2-1-3-6-18/h1-11,16H,12-15,17H2,(H,26,30)(H,27,29,31)