N-[2-(5-cyclohex-2-en-1-ylsulfanyl-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]ethanamide

Systemtic Name: N-[2-(5-cyclohex-2-en-1-ylsulfanyl-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]ethanamide Openeye Name: N-[2-(5-cyclohex-2-en-1-ylsulfanyl-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]acetamide CAS Name: N-[2-[5-(1-cyclohex-2-enylthio)-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl]ethyl]acetamide IUPAC Name: N-[2-(5-cyclohex-2-en-1-ylsulfanyl-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethyl]acetamide Traditional Name: N-[2-[5-(cyclohex-2-en-1-ylthio)-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl]ethyl]acetamide Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=C(NC2=NC=C(C=C12)SC3CCCC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCC1=C(NC2=NC=C(C=C12)SC3CCCC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS/c1-16(27)24-13-12-20-21-14-19(28-18-10-6-3-7-11-18)15-25-23(21)26-22(20)17-8-4-2-5-9-17/h2,4-6,8-10,14-15,18H,3,7,11-13H2,1H3,(H,24,27)(H,25,26)