2,6-bis(chloranyl)-N-[4-(1H-imidazol-2-ylsulfanyl)-3-prop-2-enyl-quinolin-8-yl]benzamide

Systemtic Name: 2,6-bis(chloranyl)-N-[4-(1H-imidazol-2-ylsulfanyl)-3-prop-2-enyl-quinolin-8-yl]benzamide Openeye Name: N-[3-allyl-4-(1H-imidazol-2-ylsulfanyl)-8-quinolyl]-2,6-dichloro-benzamide CAS Name: 2,6-dichloro-N-[4-(1H-imidazol-2-ylthio)-3-prop-2-enyl-8-quinolinyl]benzamide IUPAC Name: 2,6-dichloro-N-[4-(1H-imidazol-2-ylsulfanyl)-3-prop-2-enylquinolin-8-yl]benzamide Traditional Name: N-[3-allyl-4-(1H-imidazol-2-ylthio)-8-quinolyl]-2,6-dichloro-benzamide Formula: C22H16Cl2N4OS MolecularWeight: 455.35964

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CN=C2C(=C1SC3=NC=CN3)C=CC=C2NC(=O)C4=C(C=CC=C4Cl)Cl

Isomeric SMILES

C=CCC1=CN=C2C(=C1SC3=NC=CN3)C=CC=C2NC(=O)C4=C(C=CC=C4Cl)Cl

InChI

InChI=1S/C22H16Cl2N4OS/c1-2-5-13-12-27-19-14(20(13)30-22-25-10-11-26-22)6-3-9-17(19)28-21(29)18-15(23)7-4-8-16(18)24/h2-4,6-12H,1,5H2,(H,25,26)(H,28,29)