5-(3-chloranyl-4-methyl-phenyl)-N-(quinolin-8-ylcarbamothioyl)furan-2-carboxamide

Systemtic Name: 5-(3-chloranyl-4-methyl-phenyl)-N-(quinolin-8-ylcarbamothioyl)furan-2-carboxamide Openeye Name: 5-(3-chloro-4-methyl-phenyl)-N-(8-quinolylcarbamothioyl)furan-2-carboxamide CAS Name: 5-(3-chloro-4-methylphenyl)-N-[(8-quinolinylamino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3-chloro-4-methylphenyl)-N-(quinolin-8-ylcarbamothioyl)furan-2-carboxamide Traditional Name: 5-(3-chloro-4-methyl-phenyl)-N-(8-quinolylthiocarbamoyl)-2-furamide Formula: C22H16ClN3O2S MolecularWeight: 421.89934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=CC=CC4=C3N=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=CC=CC4=C3N=CC=C4)Cl

InChI

InChI=1S/C22H16ClN3O2S/c1-13-7-8-15(12-16(13)23)18-9-10-19(28-18)21(27)26-22(29)25-17-6-2-4-14-5-3-11-24-20(14)17/h2-12H,1H3,(H2,25,26,27,29)