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

Systemtic Name: 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(2-methoxy-4-nitro-phenyl)propanamide Openeye Name: 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(2-methoxy-4-nitro-phenyl)propanamide CAS Name: 2-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]thio]-N-(2-methoxy-4-nitrophenyl)propanamide IUPAC Name: 2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(2-methoxy-4-nitrophenyl)propanamide Traditional Name: 2-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]thio]-N-(2-methoxy-4-nitro-phenyl)propionamide Formula: C14H16N4O4S3 MolecularWeight: 400.49624

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)SC(C)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCSC1=NN=C(S1)SC(C)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C14H16N4O4S3/c1-4-23-13-16-17-14(25-13)24-8(2)12(19)15-10-6-5-9(18(20)21)7-11(10)22-3/h5-8H,4H2,1-3H3,(H,15,19)