2-[(4-methoxyphenyl)methylsulfanyl]-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,3,4-thiadiazole

Systemtic Name: 2-[(4-methoxyphenyl)methylsulfanyl]-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,3,4-thiadiazole Openeye Name: 2-[(4-methoxyphenyl)methylsulfanyl]-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,3,4-thiadiazole CAS Name: 2-[(4-methoxyphenyl)methylthio]-5-[1-(3-nitrophenyl)ethylthio]-1,3,4-thiadiazole IUPAC Name: 2-[(4-methoxyphenyl)methylsulfanyl]-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,3,4-thiadiazole Traditional Name: 2-[1-(3-nitrophenyl)ethylthio]-5-(p-anisylthio)-1,3,4-thiadiazole Formula: C18H17N3O3S3 MolecularWeight: 419.54088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(S2)SCC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(S2)SCC3=CC=C(C=C3)OC

InChI

InChI=1S/C18H17N3O3S3/c1-12(14-4-3-5-15(10-14)21(22)23)26-18-20-19-17(27-18)25-11-13-6-8-16(24-2)9-7-13/h3-10,12H,11H2,1-2H3