N-(2-methoxyethyl)-2-[2-(phenylsulfonylamino)ethanoyl-prop-2-enyl-amino]-2-pyridin-4-yl-ethanamide

Systemtic Name: N-(2-methoxyethyl)-2-[2-(phenylsulfonylamino)ethanoyl-prop-2-enyl-amino]-2-pyridin-4-yl-ethanamide Openeye Name: 2-[allyl-[2-(benzenesulfonamido)acetyl]amino]-N-(2-methoxyethyl)-2-(4-pyridyl)acetamide CAS Name: 2-[[2-(benzenesulfonamido)-1-oxoethyl]-prop-2-enylamino]-N-(2-methoxyethyl)-2-pyridin-4-ylacetamide IUPAC Name: 2-[[2-(benzenesulfonamido)acetyl]-prop-2-enylamino]-N-(2-methoxyethyl)-2-pyridin-4-ylacetamide Traditional Name: 2-[allyl-[2-(benzenesulfonamido)acetyl]amino]-N-(2-methoxyethyl)-2-(4-pyridyl)acetamide Formula: C21H26N4O5S MolecularWeight: 446.51994

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C(C1=CC=NC=C1)N(CC=C)C(=O)CNS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COCCNC(=O)C(C1=CC=NC=C1)N(CC=C)C(=O)CNS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H26N4O5S/c1-3-14-25(19(26)16-24-31(28,29)18-7-5-4-6-8-18)20(17-9-11-22-12-10-17)21(27)23-13-15-30-2/h3-12,20,24H,1,13-16H2,2H3,(H,23,27)