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

Systemtic Name: 3-methyl-N-[[4-(thiophen-2-ylcarbonylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: 3-methyl-N-[[4-(thiophene-2-carbonylamino)phenyl]carbamothioyl]benzofuran-2-carboxamide CAS Name: 3-methyl-N-[[4-[[oxo(thiophen-2-yl)methyl]amino]anilino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: 3-methyl-N-[[4-(thiophene-2-carbonylamino)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: 3-methyl-N-[[4-(2-thenoylamino)phenyl]thiocarbamoyl]coumarilamide Formula: C22H17N3O3S2 MolecularWeight: 435.51868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NC(=S)NC3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NC(=S)NC3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H17N3O3S2/c1-13-16-5-2-3-6-17(16)28-19(13)21(27)25-22(29)24-15-10-8-14(9-11-15)23-20(26)18-7-4-12-30-18/h2-12H,1H3,(H,23,26)(H2,24,25,27,29)