N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[(4-morpholinosulfonylphenyl)methyl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-(4-morpholinosulfonylbenzyl)-2-(phenylthio)nicotinamide Formula: C23H23N3O4S2 MolecularWeight: 469.57642

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C23H23N3O4S2/c27-22(21-7-4-12-24-23(21)31-19-5-2-1-3-6-19)25-17-18-8-10-20(11-9-18)32(28,29)26-13-15-30-16-14-26/h1-12H,13-17H2,(H,25,27)