2-[5-bromanyl-4-(4-chlorophenyl)sulfanyl-7-cyano-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]ethanoate

Systemtic Name: 2-[5-bromanyl-4-(4-chlorophenyl)sulfanyl-7-cyano-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]ethanoate Openeye Name: 2-[5-bromo-4-(4-chlorophenyl)sulfanyl-7-cyano-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]acetate CAS Name: 2-[5-bromo-4-[(4-chlorophenyl)thio]-7-cyano-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]acetate IUPAC Name: 2-[5-bromo-4-(4-chlorophenyl)sulfanyl-7-cyano-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]acetate Traditional Name: 2-[5-bromo-4-[(4-chlorophenyl)thio]-7-cyano-2,3-dihydro-1H-pyrrol[1,2-a]indol-3-yl]acetate Formula: C20H13BrClN2O2S- MolecularWeight: 460.75142

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C3=C(C(=CC(=C3)C#N)Br)C(=C2C1CC(=O)[O-])SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN2C3=C(C(=CC(=C3)C#N)Br)C(=C2C1CC(=O)[O-])SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H14BrClN2O2S/c21-15-7-11(10-23)8-16-18(15)20(27-14-3-1-13(22)2-4-14)19-12(9-17(25)26)5-6-24(16)19/h1-4,7-8,12H,5-6,9H2,(H,25,26)/p-1