2-iodanyl-N-[[4-(piperidin-1-ylmethyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-iodanyl-N-[[4-(piperidin-1-ylmethyl)phenyl]carbamothioyl]benzamide Openeye Name: 2-iodo-N-[[4-(1-piperidylmethyl)phenyl]carbamothioyl]benzamide CAS Name: 2-iodo-N-[[4-(1-piperidinylmethyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-iodo-N-[[4-(piperidin-1-ylmethyl)phenyl]carbamothioyl]benzamide Traditional Name: 2-iodo-N-[[4-(piperidinomethyl)phenyl]thiocarbamoyl]benzamide Formula: C20H22IN3OS MolecularWeight: 479.37765

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3I

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C20H22IN3OS/c21-18-7-3-2-6-17(18)19(25)23-20(26)22-16-10-8-15(9-11-16)14-24-12-4-1-5-13-24/h2-3,6-11H,1,4-5,12-14H2,(H2,22,23,25,26)