N-[[4-(diethylamino)phenyl]carbamothioyl]-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[[4-(diethylamino)phenyl]carbamothioyl]-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[[4-(diethylamino)phenyl]carbamothioyl]-3-methyl-benzofuran-2-carboxamide CAS Name: N-[[4-(diethylamino)anilino]-sulfanylidenemethyl]-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[[4-(diethylamino)phenyl]carbamothioyl]-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[[4-(diethylamino)phenyl]thiocarbamoyl]-3-methyl-coumarilamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C3=CC=CC=C3O2)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C3=CC=CC=C3O2)C

InChI

InChI=1S/C21H23N3O2S/c1-4-24(5-2)16-12-10-15(11-13-16)22-21(27)23-20(25)19-14(3)17-8-6-7-9-18(17)26-19/h6-13H,4-5H2,1-3H3,(H2,22,23,25,27)