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

Systemtic Name: 3-[5-[2,3-bis(chloranyl)phenyl]furan-2-yl]-N-[[3-chloranyl-2-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]prop-2-enamide Openeye Name: N-[[3-chloro-2-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]-3-[5-(2,3-dichlorophenyl)-2-furyl]prop-2-enamide CAS Name: N-[[3-chloro-2-(4-ethyl-1-piperazinyl)anilino]-sulfanylidenemethyl]-3-[5-(2,3-dichlorophenyl)-2-furanyl]-2-propenamide IUPAC Name: N-[[3-chloro-2-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]-3-[5-(2,3-dichlorophenyl)furan-2-yl]prop-2-enamide Traditional Name: N-[[3-chloro-2-(4-ethylpiperazino)phenyl]thiocarbamoyl]-3-[5-(2,3-dichlorophenyl)-2-furyl]acrylamide Formula: C26H25Cl3N4O2S MolecularWeight: 563.9263

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C=CC3=CC=C(O3)C4=C(C(=CC=C4)Cl)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C=CC3=CC=C(O3)C4=C(C(=CC=C4)Cl)Cl

InChI

InChI=1S/C26H25Cl3N4O2S/c1-2-32-13-15-33(16-14-32)25-20(28)7-4-8-21(25)30-26(36)31-23(34)12-10-17-9-11-22(35-17)18-5-3-6-19(27)24(18)29/h3-12H,2,13-16H2,1H3,(H2,30,31,34,36)