2-(2-methylpropylsulfanyl)-5-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-1,3,4-thiadiazole

Systemtic Name: 2-(2-methylpropylsulfanyl)-5-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-1,3,4-thiadiazole Openeye Name: 2-isobutylsulfanyl-5-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-1,3,4-thiadiazole CAS Name: 2-(2-methylpropylthio)-5-[[(1R)-1-(3-nitrophenyl)ethyl]thio]-1,3,4-thiadiazole IUPAC Name: 2-(2-methylpropylsulfanyl)-5-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-1,3,4-thiadiazole Traditional Name: 2-(isobutylthio)-5-[[(1R)-1-(3-nitrophenyl)ethyl]thio]-1,3,4-thiadiazole Formula: C14H17N3O2S3 MolecularWeight: 355.49868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(S2)SCC(C)C

InChI

InChI=1S/C14H17N3O2S3/c1-9(2)8-20-13-15-16-14(22-13)21-10(3)11-5-4-6-12(7-11)17(18)19/h4-7,9-10H,8H2,1-3H3/t10-/m1/s1