N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-2-[methyl(pyridin-3-ylsulfonyl)amino]ethanamide

Systemtic Name: N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-2-[methyl(pyridin-3-ylsulfonyl)amino]ethanamide Openeye Name: N-(6-chlorothiochroman-4-yl)-2-[methyl(3-pyridylsulfonyl)amino]acetamide CAS Name: N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-[methyl(3-pyridinylsulfonyl)amino]acetamide IUPAC Name: N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-2-[methyl(pyridin-3-ylsulfonyl)amino]acetamide Traditional Name: N-(6-chlorothiochroman-4-yl)-2-[methyl(3-pyridylsulfonyl)amino]acetamide Formula: C17H18ClN3O3S2 MolecularWeight: 411.92612

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1CCSC2=C1C=C(C=C2)Cl)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CN(CC(=O)NC1CCSC2=C1C=C(C=C2)Cl)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C17H18ClN3O3S2/c1-21(26(23,24)13-3-2-7-19-10-13)11-17(22)20-15-6-8-25-16-5-4-12(18)9-14(15)16/h2-5,7,9-10,15H,6,8,11H2,1H3,(H,20,22)