1-(4-chloranyl-1H-indol-3-yl)-2-[4-(4-chloranyl-2-sulfanyl-phenyl)carbonylpiperazin-1-yl]ethane-1,2-dione

Systemtic Name: 1-(4-chloranyl-1H-indol-3-yl)-2-[4-(4-chloranyl-2-sulfanyl-phenyl)carbonylpiperazin-1-yl]ethane-1,2-dione Openeye Name: 1-(4-chloro-1H-indol-3-yl)-2-[4-(4-chloro-2-sulfanyl-benzoyl)piperazin-1-yl]ethane-1,2-dione CAS Name: 1-(4-chloro-1H-indol-3-yl)-2-[4-[(4-chloro-2-mercaptophenyl)-oxomethyl]-1-piperazinyl]ethane-1,2-dione IUPAC Name: 1-(4-chloro-1H-indol-3-yl)-2-[4-(4-chloro-2-sulfanylbenzoyl)piperazin-1-yl]ethane-1,2-dione Traditional Name: 1-(4-chloro-1H-indol-3-yl)-2-[4-(4-chloro-2-mercapto-benzoyl)piperazino]ethane-1,2-dione Formula: C21H17Cl2N3O3S MolecularWeight: 462.34898

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=C(C=C(C=C2)Cl)S)C(=O)C(=O)C3=CNC4=C3C(=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=C(C=C(C=C2)Cl)S)C(=O)C(=O)C3=CNC4=C3C(=CC=C4)Cl

InChI

InChI=1S/C21H17Cl2N3O3S/c22-12-4-5-13(17(30)10-12)20(28)25-6-8-26(9-7-25)21(29)19(27)14-11-24-16-3-1-2-15(23)18(14)16/h1-5,10-11,24,30H,6-9H2