N-[4-[2-methylsulfanyl-4-(oxolan-2-yl)indol-1-yl]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[4-[2-methylsulfanyl-4-(oxolan-2-yl)indol-1-yl]phenyl]pyridine-3-carboxamide Openeye Name: N-[4-(2-methylsulfanyl-4-tetrahydrofuran-2-yl-indol-1-yl)phenyl]pyridine-3-carboxamide CAS Name: N-[4-[2-(methylthio)-4-(2-oxolanyl)-1-indolyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[2-methylsulfanyl-4-(oxolan-2-yl)indol-1-yl]phenyl]pyridine-3-carboxamide Traditional Name: N-[4-[2-(methylthio)-4-(tetrahydrofuryl)indol-1-yl]phenyl]nicotinamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=CC=C2N1C3=CC=C(C=C3)NC(=O)C4=CN=CC=C4)C5CCCO5

Isomeric SMILES

CSC1=CC2=C(C=CC=C2N1C3=CC=C(C=C3)NC(=O)C4=CN=CC=C4)C5CCCO5

InChI

InChI=1S/C25H23N3O2S/c1-31-24-15-21-20(23-8-4-14-30-23)6-2-7-22(21)28(24)19-11-9-18(10-12-19)27-25(29)17-5-3-13-26-16-17/h2-3,5-7,9-13,15-16,23H,4,8,14H2,1H3,(H,27,29)