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

Systemtic Name: 3-[5-[2,3-bis(chloranyl)phenyl]furan-2-yl]-N-[[3-chloranyl-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]carbamothioyl]prop-2-enamide Openeye Name: N-[[3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]carbamothioyl]-3-[5-(2,3-dichlorophenyl)-2-furyl]prop-2-enamide CAS Name: N-[[3-chloro-4-[4-[(2-chlorophenyl)methyl]-1-piperazinyl]anilino]-sulfanylidenemethyl]-3-[5-(2,3-dichlorophenyl)-2-furanyl]-2-propenamide IUPAC Name: N-[[3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]carbamothioyl]-3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enamide Traditional Name: N-[[3-chloro-4-[4-(2-chlorobenzyl)piperazino]phenyl]thiocarbamoyl]-3-[5-(2,3-dichlorophenyl)-2-furyl]acrylamide Formula: C31H26Cl4N4O2S MolecularWeight: 660.44074

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2Cl)C3=C(C=C(C=C3)NC(=S)NC(=O)C=CC4=CC=C(O4)C5=C(C(=CC=C5)Cl)Cl)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2Cl)C3=C(C=C(C=C3)NC(=S)NC(=O)C=CC4=CC=C(O4)C5=C(C(=CC=C5)Cl)Cl)Cl

InChI

InChI=1S/C31H26Cl4N4O2S/c32-24-6-2-1-4-20(24)19-38-14-16-39(17-15-38)27-11-8-21(18-26(27)34)36-31(42)37-29(40)13-10-22-9-12-28(41-22)23-5-3-7-25(33)30(23)35/h1-13,18H,14-17,19H2,(H2,36,37,40,42)