N-(2-methoxy-5-nitro-phenyl)-2-[[5-[(4-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-2-[[5-[(4-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-methoxy-5-nitro-phenyl)acetamide CAS Name: 2-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]-N-(2-methoxy-5-nitrophenyl)acetamide IUPAC Name: 2-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-methoxy-5-nitrophenyl)acetamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-2-[[5-(p-anisidino)-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C18H17N5O5S2 MolecularWeight: 447.48808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H17N5O5S2/c1-27-13-6-3-11(4-7-13)19-17-21-22-18(30-17)29-10-16(24)20-14-9-12(23(25)26)5-8-15(14)28-2/h3-9H,10H2,1-2H3,(H,19,21)(H,20,24)