N-[(4-methoxyphenyl)methyl]-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonyl-ethyl)ethanediamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonyl-ethyl)ethanediamide Openeye Name: N-[(4-methoxyphenyl)methyl]-N'-[2-(3-pyridyl)-2-(2-thienylsulfonyl)ethyl]oxamide CAS Name: N-[(4-methoxyphenyl)methyl]-N'-[2-(3-pyridinyl)-2-thiophen-2-ylsulfonylethyl]oxamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonylethyl)oxamide Traditional Name: N-p-anisyl-N'-[2-(3-pyridyl)-2-(2-thienylsulfonyl)ethyl]oxamide Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H21N3O5S2/c1-29-17-8-6-15(7-9-17)12-23-20(25)21(26)24-14-18(16-4-2-10-22-13-16)31(27,28)19-5-3-11-30-19/h2-11,13,18H,12,14H2,1H3,(H,23,25)(H,24,26)