N-[[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]furan-2-carboxamide

Systemtic Name: N-[[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]furan-2-carboxamide Openeye Name: N-[[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]furan-2-carboxamide CAS Name: N-[[[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]furan-2-carboxamide Traditional Name: N-[[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]-2-furamide Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=CO4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=CO4

InChI

InChI=1S/C21H18N4O3S/c1-25(2)15-8-5-13(6-9-15)20-23-16-12-14(7-10-17(16)28-20)22-21(29)24-19(26)18-4-3-11-27-18/h3-12H,1-2H3,(H2,22,24,26,29)