5-[2,3-bis(chloranyl)phenyl]-N-[[4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-[2,3-bis(chloranyl)phenyl]-N-[[4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: N-[[4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]carbamothioyl]-5-(2,3-dichlorophenyl)furan-2-carboxamide CAS Name: N-[[4-[4-[(2-chlorophenyl)methyl]-1-piperazinyl]anilino]-sulfanylidenemethyl]-5-(2,3-dichlorophenyl)-2-furancarboxamide IUPAC Name: N-[[4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]carbamothioyl]-5-(2,3-dichlorophenyl)furan-2-carboxamide Traditional Name: N-[[4-[4-(2-chlorobenzyl)piperazino]phenyl]thiocarbamoyl]-5-(2,3-dichlorophenyl)-2-furamide Formula: C29H25Cl3N4O2S MolecularWeight: 599.9584

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2Cl)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=C(O4)C5=C(C(=CC=C5)Cl)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2Cl)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC=C(O4)C5=C(C(=CC=C5)Cl)Cl

InChI

InChI=1S/C29H25Cl3N4O2S/c30-23-6-2-1-4-19(23)18-35-14-16-36(17-15-35)21-10-8-20(9-11-21)33-29(39)34-28(37)26-13-12-25(38-26)22-5-3-7-24(31)27(22)32/h1-13H,14-18H2,(H2,33,34,37,39)