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

Systemtic Name: N-[[4-(4-butanoylpiperazin-1-yl)phenyl]carbamothioyl]propanamide Openeye Name: N-[[4-(4-butanoylpiperazin-1-yl)phenyl]carbamothioyl]propanamide CAS Name: N-[[4-[4-(1-oxobutyl)-1-piperazinyl]anilino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[[4-(4-butanoylpiperazin-1-yl)phenyl]carbamothioyl]propanamide Traditional Name: N-[[4-(4-butyrylpiperazino)phenyl]thiocarbamoyl]propionamide Formula: C18H26N4O2S MolecularWeight: 362.48964

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)CC

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)CC

InChI

InChI=1S/C18H26N4O2S/c1-3-5-17(24)22-12-10-21(11-13-22)15-8-6-14(7-9-15)19-18(25)20-16(23)4-2/h6-9H,3-5,10-13H2,1-2H3,(H2,19,20,23,25)