2,4-bis(chloranyl)-N-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbothioyl-benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbothioyl-benzamide Openeye Name: 2,4-dichloro-N-[4-[(E)-cinnamyl]piperazine-1-carbothioyl]benzamide CAS Name: 2,4-dichloro-N-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dichloro-N-[4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioyl]benzamide Traditional Name: 2,4-dichloro-N-[4-[(E)-cinnamyl]piperazine-1-carbothioyl]benzamide Formula: C21H21Cl2N3OS MolecularWeight: 434.38194

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)C(=S)NC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C/C=C/C2=CC=CC=C2)C(=S)NC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H21Cl2N3OS/c22-17-8-9-18(19(23)15-17)20(27)24-21(28)26-13-11-25(12-14-26)10-4-7-16-5-2-1-3-6-16/h1-9,15H,10-14H2,(H,24,27,28)/b7-4+