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

Systemtic Name: 2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-methoxy-4-nitro-phenyl)ethanamide Openeye Name: 2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-methoxy-4-nitro-phenyl)acetamide CAS Name: 2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(2-methoxy-4-nitrophenyl)acetamide IUPAC Name: 2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-methoxy-4-nitrophenyl)acetamide Traditional Name: 2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(2-methoxy-4-nitro-phenyl)acetamide Formula: C14H15N5O4S2 MolecularWeight: 381.43

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NN=C(S2)NC3CC3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NN=C(S2)NC3CC3

InChI

InChI=1S/C14H15N5O4S2/c1-23-11-6-9(19(21)22)4-5-10(11)16-12(20)7-24-14-18-17-13(25-14)15-8-2-3-8/h4-6,8H,2-3,7H2,1H3,(H,15,17)(H,16,20)