3-chloranyl-N-[[3-chloranyl-2-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl]-4-methoxy-benzamide

Systemtic Name: 3-chloranyl-N-[[3-chloranyl-2-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl]-4-methoxy-benzamide Openeye Name: 3-chloro-N-[[3-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl]-4-methoxy-benzamide CAS Name: 3-chloro-N-[[3-chloro-2-[4-(1-oxopropyl)-1-piperazinyl]anilino]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-chloro-N-[[3-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl]-4-methoxybenzamide Traditional Name: 3-chloro-N-[[3-chloro-2-(4-propionylpiperazino)phenyl]thiocarbamoyl]-4-methoxy-benzamide Formula: C22H24Cl2N4O3S MolecularWeight: 495.42196

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C22H24Cl2N4O3S/c1-3-19(29)27-9-11-28(12-10-27)20-15(23)5-4-6-17(20)25-22(32)26-21(30)14-7-8-18(31-2)16(24)13-14/h4-8,13H,3,9-12H2,1-2H3,(H2,25,26,30,32)