N'-ethyl-N'-(phenylmethyl)-N-(2-pyridin-3-yl-2-thiophen-2-ylsulfonyl-ethyl)ethanediamide

Systemtic Name: N'-ethyl-N'-(phenylmethyl)-N-(2-pyridin-3-yl-2-thiophen-2-ylsulfonyl-ethyl)ethanediamide Openeye Name: N'-benzyl-N'-ethyl-N-[2-(3-pyridyl)-2-(2-thienylsulfonyl)ethyl]oxamide CAS Name: N'-ethyl-N'-(phenylmethyl)-N-[2-(3-pyridinyl)-2-thiophen-2-ylsulfonylethyl]oxamide IUPAC Name: N'-benzyl-N'-ethyl-N-(2-pyridin-3-yl-2-thiophen-2-ylsulfonylethyl)oxamide Traditional Name: N'-benzyl-N'-ethyl-N-[2-(3-pyridyl)-2-(2-thienylsulfonyl)ethyl]oxamide Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)C(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C22H23N3O4S2/c1-2-25(16-17-8-4-3-5-9-17)22(27)21(26)24-15-19(18-10-6-12-23-14-18)31(28,29)20-11-7-13-30-20/h3-14,19H,2,15-16H2,1H3,(H,24,26)