N-[[2-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[[2-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[[2-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[2-(4-methyl-1-piperazinyl)anilino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[[2-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[[2-(4-methylpiperazino)phenyl]thiocarbamoyl]coumarilamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C21H22N4O2S/c1-24-10-12-25(13-11-24)17-8-4-3-7-16(17)22-21(28)23-20(26)19-14-15-6-2-5-9-18(15)27-19/h2-9,14H,10-13H2,1H3,(H2,22,23,26,28)