N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)sulfanylcarbamoylamino]phenyl]pyridine-4-carboxamide

Systemtic Name: N-[4-[(5-chloranyl-2,4-dimethoxy-phenyl)sulfanylcarbamoylamino]phenyl]pyridine-4-carboxamide Openeye Name: N-[4-[(5-chloro-2,4-dimethoxy-phenyl)sulfanylcarbamoylamino]phenyl]pyridine-4-carboxamide CAS Name: N-[4-[[[[(5-chloro-2,4-dimethoxyphenyl)thio]amino]-oxomethyl]amino]phenyl]-4-pyridinecarboxamide IUPAC Name: N-[4-[(5-chloro-2,4-dimethoxyphenyl)sulfanylcarbamoylamino]phenyl]pyridine-4-carboxamide Traditional Name: N-[4-[[(5-chloro-2,4-dimethoxy-phenyl)thio]carbamoylamino]phenyl]isonicotinamide Formula: C21H19ClN4O4S MolecularWeight: 458.91796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1SNC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=NC=C3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1SNC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=NC=C3)Cl)OC

InChI

InChI=1S/C21H19ClN4O4S/c1-29-17-12-18(30-2)19(11-16(17)22)31-26-21(28)25-15-5-3-14(4-6-15)24-20(27)13-7-9-23-10-8-13/h3-12H,1-2H3,(H,24,27)(H2,25,26,28)