3,5-bis(chloranyl)-N-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]-2-methoxy-benzamide

Systemtic Name: 3,5-bis(chloranyl)-N-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]-2-methoxy-benzamide Openeye Name: 3,5-dichloro-N-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]-2-methoxy-benzamide CAS Name: 3,5-dichloro-N-[[4-(4-ethyl-1-piperazinyl)anilino]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 3,5-dichloro-N-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]-2-methoxybenzamide Traditional Name: 3,5-dichloro-N-[[4-(4-ethylpiperazino)phenyl]thiocarbamoyl]-2-methoxy-benzamide Formula: C21H24Cl2N4O2S MolecularWeight: 467.41186

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC(=C3OC)Cl)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC(=C3OC)Cl)Cl

InChI

InChI=1S/C21H24Cl2N4O2S/c1-3-26-8-10-27(11-9-26)16-6-4-15(5-7-16)24-21(30)25-20(28)17-12-14(22)13-18(23)19(17)29-2/h4-7,12-13H,3,8-11H2,1-2H3,(H2,24,25,28,30)