N-[5-chloranyl-3-(phenylcarbonyl)pyridin-2-yl]-4-propan-2-ylsulfanyl-benzenesulfonamide

Systemtic Name: N-[5-chloranyl-3-(phenylcarbonyl)pyridin-2-yl]-4-propan-2-ylsulfanyl-benzenesulfonamide Openeye Name: N-(3-benzoyl-5-chloro-2-pyridyl)-4-isopropylsulfanyl-benzenesulfonamide CAS Name: N-(3-benzoyl-5-chloro-2-pyridinyl)-4-(propan-2-ylthio)benzenesulfonamide IUPAC Name: N-(3-benzoyl-5-chloropyridin-2-yl)-4-propan-2-ylsulfanylbenzenesulfonamide Traditional Name: N-(3-benzoyl-5-chloro-2-pyridyl)-4-(isopropylthio)benzenesulfonamide Formula: C21H19ClN2O3S2 MolecularWeight: 446.97016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)S(=O)(=O)NC2=NC=C(C=C2C(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)S(=O)(=O)NC2=NC=C(C=C2C(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C21H19ClN2O3S2/c1-14(2)28-17-8-10-18(11-9-17)29(26,27)24-21-19(12-16(22)13-23-21)20(25)15-6-4-3-5-7-15/h3-14H,1-2H3,(H,23,24)