3-butoxy-N-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[4-(4-ethyl-1-piperazinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[4-(4-ethylpiperazino)phenyl]thiocarbamoyl]benzamide Formula: C24H32N4O2S MolecularWeight: 440.60148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCN(CC3)CC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCN(CC3)CC

InChI

InChI=1S/C24H32N4O2S/c1-3-5-17-30-22-8-6-7-19(18-22)23(29)26-24(31)25-20-9-11-21(12-10-20)28-15-13-27(4-2)14-16-28/h6-12,18H,3-5,13-17H2,1-2H3,(H2,25,26,29,31)