2-[[5-(2-methylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-nitrophenyl)ethanamide

Systemtic Name: 2-[[5-(2-methylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-nitrophenyl)ethanamide Openeye Name: 2-[(5-isobutylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide CAS Name: 2-[[5-(2-methylpropylthio)-1,3,4-thiadiazol-2-yl]thio]-N-(4-nitrophenyl)acetamide IUPAC Name: 2-[[5-(2-methylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-nitrophenyl)acetamide Traditional Name: 2-[[5-(isobutylthio)-1,3,4-thiadiazol-2-yl]thio]-N-(4-nitrophenyl)acetamide Formula: C14H16N4O3S3 MolecularWeight: 384.49684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(S1)SCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CSC1=NN=C(S1)SCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O3S3/c1-9(2)7-22-13-16-17-14(24-13)23-8-12(19)15-10-3-5-11(6-4-10)18(20)21/h3-6,9H,7-8H2,1-2H3,(H,15,19)