N-[2-[[5-(piperidin-1-ylmethyl)thiophen-2-yl]methylsulfanyl]ethylcarbamothioyl]benzamide

Systemtic Name: N-[2-[[5-(piperidin-1-ylmethyl)thiophen-2-yl]methylsulfanyl]ethylcarbamothioyl]benzamide Openeye Name: N-[2-[[5-(1-piperidylmethyl)-2-thienyl]methylsulfanyl]ethylcarbamothioyl]benzamide CAS Name: N-[[2-[[5-(1-piperidinylmethyl)-2-thiophenyl]methylthio]ethylamino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[2-[[5-(piperidin-1-ylmethyl)thiophen-2-yl]methylsulfanyl]ethylcarbamothioyl]benzamide Traditional Name: N-[2-[[5-(piperidinomethyl)-2-thienyl]methylthio]ethylthiocarbamoyl]benzamide Formula: C21H27N3OS3 MolecularWeight: 433.65358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(S2)CSCCNC(=S)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(S2)CSCCNC(=S)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3OS3/c25-20(17-7-3-1-4-8-17)23-21(26)22-11-14-27-16-19-10-9-18(28-19)15-24-12-5-2-6-13-24/h1,3-4,7-10H,2,5-6,11-16H2,(H2,22,23,25,26)