2,6-bis(chloranyl)-N-[4-imidazol-1-yl-3-(methylsulfanylmethyl)quinolin-8-yl]benzamide

Systemtic Name: 2,6-bis(chloranyl)-N-[4-imidazol-1-yl-3-(methylsulfanylmethyl)quinolin-8-yl]benzamide Openeye Name: 2,6-dichloro-N-[4-imidazol-1-yl-3-(methylsulfanylmethyl)-8-quinolyl]benzamide CAS Name: 2,6-dichloro-N-[4-(1-imidazolyl)-3-[(methylthio)methyl]-8-quinolinyl]benzamide IUPAC Name: 2,6-dichloro-N-[4-imidazol-1-yl-3-(methylsulfanylmethyl)quinolin-8-yl]benzamide Traditional Name: 2,6-dichloro-N-[4-imidazol-1-yl-3-[(methylthio)methyl]-8-quinolyl]benzamide Formula: C21H16Cl2N4OS MolecularWeight: 443.34894

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CN=C2C(=C1N3C=CN=C3)C=CC=C2NC(=O)C4=C(C=CC=C4Cl)Cl

Isomeric SMILES

CSCC1=CN=C2C(=C1N3C=CN=C3)C=CC=C2NC(=O)C4=C(C=CC=C4Cl)Cl

InChI

InChI=1S/C21H16Cl2N4OS/c1-29-11-13-10-25-19-14(20(13)27-9-8-24-12-27)4-2-7-17(19)26-21(28)18-15(22)5-3-6-16(18)23/h2-10,12H,11H2,1H3,(H,26,28)