N-[[4-(4-butanoylpiperazin-1-yl)phenyl]carbamothioyl]hexanamide

Systemtic Name: N-[[4-(4-butanoylpiperazin-1-yl)phenyl]carbamothioyl]hexanamide Openeye Name: N-[[4-(4-butanoylpiperazin-1-yl)phenyl]carbamothioyl]hexanamide CAS Name: N-[[4-[4-(1-oxobutyl)-1-piperazinyl]anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[4-(4-butanoylpiperazin-1-yl)phenyl]carbamothioyl]hexanamide Traditional Name: N-[[4-(4-butyrylpiperazino)phenyl]thiocarbamoyl]hexanamide Formula: C21H32N4O2S MolecularWeight: 404.56938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N4O2S/c1-3-5-6-8-19(26)23-21(28)22-17-9-11-18(12-10-17)24-13-15-25(16-14-24)20(27)7-4-2/h9-12H,3-8,13-16H2,1-2H3,(H2,22,23,26,28)