N-(3-acetamido-4-methoxy-phenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(3-acetamido-4-methoxy-phenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(3-acetamido-4-methoxy-phenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)pyridine-3-carboxamide CAS Name: N-(3-acetamido-4-methoxyphenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-3-pyridinecarboxamide IUPAC Name: N-(3-acetamido-4-methoxyphenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(3-acetamido-4-methoxy-phenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)nicotinamide Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=C(N=CC=C2)SC3=CC4=C(C=C3)OCCO4)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=C(N=CC=C2)SC3=CC4=C(C=C3)OCCO4)OC

InChI

InChI=1S/C23H21N3O5S/c1-14(27)25-18-12-15(5-7-19(18)29-2)26-22(28)17-4-3-9-24-23(17)32-16-6-8-20-21(13-16)31-11-10-30-20/h3-9,12-13H,10-11H2,1-2H3,(H,25,27)(H,26,28)