N-[[4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]carbamothioyl]hexanamide

Systemtic Name: N-[[4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]carbamothioyl]hexanamide Openeye Name: N-[[4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]carbamothioyl]hexanamide CAS Name: N-[[4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]carbamothioyl]hexanamide Traditional Name: N-[[4-[4-(2-thenoyl)piperazino]phenyl]thiocarbamoyl]hexanamide Formula: C22H28N4O2S2 MolecularWeight: 444.61332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C22H28N4O2S2/c1-2-3-4-7-20(27)24-22(29)23-17-8-10-18(11-9-17)25-12-14-26(15-13-25)21(28)19-6-5-16-30-19/h5-6,8-11,16H,2-4,7,12-15H2,1H3,(H2,23,24,27,29)