5-(3-chloranyl-4-methyl-phenyl)-N-[[5-chloranyl-2-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(3-chloranyl-4-methyl-phenyl)-N-[[5-chloranyl-2-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3-chloro-4-methyl-phenyl)-N-[[5-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-(3-chloro-4-methylphenyl)-N-[[5-chloro-2-[4-(1-oxopropyl)-1-piperazinyl]anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3-chloro-4-methylphenyl)-N-[[5-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3-chloro-4-methyl-phenyl)-N-[[5-chloro-2-(4-propionylpiperazino)phenyl]thiocarbamoyl]-2-furamide Formula: C26H26Cl2N4O3S MolecularWeight: 545.48064

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=S)NC(=O)C3=CC=C(O3)C4=CC(=C(C=C4)C)Cl

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=S)NC(=O)C3=CC=C(O3)C4=CC(=C(C=C4)C)Cl

InChI

InChI=1S/C26H26Cl2N4O3S/c1-3-24(33)32-12-10-31(11-13-32)21-7-6-18(27)15-20(21)29-26(36)30-25(34)23-9-8-22(35-23)17-5-4-16(2)19(28)14-17/h4-9,14-15H,3,10-13H2,1-2H3,(H2,29,30,34,36)