N-[[5-[(4-methoxyphenoxy)methyl]-1,3,4-thiadiazol-2-yl]carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[[5-[(4-methoxyphenoxy)methyl]-1,3,4-thiadiazol-2-yl]carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide Openeye Name: N-[[5-[(4-methoxyphenoxy)methyl]-1,3,4-thiadiazol-2-yl]carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide CAS Name: N-[[[5-[(4-methoxyphenoxy)methyl]-1,3,4-thiadiazol-2-yl]amino]-sulfanylidenemethyl]-5-(2-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[[5-[(4-methoxyphenoxy)methyl]-1,3,4-thiadiazol-2-yl]carbamothioyl]-5-(2-nitrophenyl)furan-2-carboxamide Traditional Name: N-[[5-[(4-methoxyphenoxy)methyl]-1,3,4-thiadiazol-2-yl]thiocarbamoyl]-5-(2-nitrophenyl)-2-furamide Formula: C22H17N5O6S2 MolecularWeight: 511.53028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC2=NN=C(S2)NC(=S)NC(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)OCC2=NN=C(S2)NC(=S)NC(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H17N5O6S2/c1-31-13-6-8-14(9-7-13)32-12-19-25-26-22(35-19)24-21(34)23-20(28)18-11-10-17(33-18)15-4-2-3-5-16(15)27(29)30/h2-11H,12H2,1H3,(H2,23,24,26,28,34)