2-phenylsulfanyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]pyridine-3-carboxamide

Systemtic Name: 2-phenylsulfanyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]pyridine-3-carboxamide Openeye Name: N-[4-(isopropylcarbamoylamino)phenyl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: 2-phenylsulfanyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]pyridine-3-carboxamide Traditional Name: N-[4-(isopropylcarbamoylamino)phenyl]-2-(phenylthio)nicotinamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C22H22N4O2S/c1-15(2)24-22(28)26-17-12-10-16(11-13-17)25-20(27)19-9-6-14-23-21(19)29-18-7-4-3-5-8-18/h3-15H,1-2H3,(H,25,27)(H2,24,26,28)