2-[(2-chloranylethanoylamino)-pyridin-4-yl-methyl]sulfanyl-N-(3-propan-2-ylphenyl)pyridine-3-carboxamide

Systemtic Name: 2-[(2-chloranylethanoylamino)-pyridin-4-yl-methyl]sulfanyl-N-(3-propan-2-ylphenyl)pyridine-3-carboxamide Openeye Name: 2-[[(2-chloroacetyl)amino]-(4-pyridyl)methyl]sulfanyl-N-(3-isopropylphenyl)pyridine-3-carboxamide CAS Name: 2-[[[(2-chloro-1-oxoethyl)amino]-pyridin-4-ylmethyl]thio]-N-(3-propan-2-ylphenyl)-3-pyridinecarboxamide IUPAC Name: 2-[[(2-chloroacetyl)amino]-pyridin-4-ylmethyl]sulfanyl-N-(3-propan-2-ylphenyl)pyridine-3-carboxamide Traditional Name: 2-[[[(2-chloroacetyl)amino]-(4-pyridyl)methyl]thio]-N-m-cumenyl-nicotinamide Formula: C23H23ClN4O2S MolecularWeight: 454.97232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)SC(C3=CC=NC=C3)NC(=O)CCl

Isomeric SMILES

CC(C)C1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)SC(C3=CC=NC=C3)NC(=O)CCl

InChI

InChI=1S/C23H23ClN4O2S/c1-15(2)17-5-3-6-18(13-17)27-21(30)19-7-4-10-26-23(19)31-22(28-20(29)14-24)16-8-11-25-12-9-16/h3-13,15,22H,14H2,1-2H3,(H,27,30)(H,28,29)