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

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-2-[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: N-(2-methoxy-4-nitrophenyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)-2-[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C17H17N5O4S3 MolecularWeight: 451.54298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NN=C(S2)NCCC3=CC=CS3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NN=C(S2)NCCC3=CC=CS3

InChI

InChI=1S/C17H17N5O4S3/c1-26-14-9-11(22(24)25)4-5-13(14)19-15(23)10-28-17-21-20-16(29-17)18-7-6-12-3-2-8-27-12/h2-5,8-9H,6-7,10H2,1H3,(H,18,20)(H,19,23)