4-(5-chloranyl-2-pyridin-2-yl-1H-indol-3-yl)-N-(2-phenylsulfanylphenyl)butanamide

Systemtic Name: 4-(5-chloranyl-2-pyridin-2-yl-1H-indol-3-yl)-N-(2-phenylsulfanylphenyl)butanamide Openeye Name: 4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]-N-(2-phenylsulfanylphenyl)butanamide CAS Name: 4-[5-chloro-2-(2-pyridinyl)-1H-indol-3-yl]-N-[2-(phenylthio)phenyl]butanamide IUPAC Name: 4-(5-chloro-2-pyridin-2-yl-1H-indol-3-yl)-N-(2-phenylsulfanylphenyl)butanamide Traditional Name: 4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]-N-[2-(phenylthio)phenyl]butyramide Formula: C29H24ClN3OS MolecularWeight: 498.03836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)CCCC3=C(NC4=C3C=C(C=C4)Cl)C5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)CCCC3=C(NC4=C3C=C(C=C4)Cl)C5=CC=CC=N5

InChI

InChI=1S/C29H24ClN3OS/c30-20-16-17-24-23(19-20)22(29(33-24)26-13-6-7-18-31-26)11-8-15-28(34)32-25-12-4-5-14-27(25)35-21-9-2-1-3-10-21/h1-7,9-10,12-14,16-19,33H,8,11,15H2,(H,32,34)