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

Systemtic Name: 2-[(4-methoxyphenyl)methylsulfanyl]-5-(2-nitrophenyl)sulfanyl-1,3,4-thiadiazole Openeye Name: 2-[(4-methoxyphenyl)methylsulfanyl]-5-(2-nitrophenyl)sulfanyl-1,3,4-thiadiazole CAS Name: 2-[(4-methoxyphenyl)methylthio]-5-[(2-nitrophenyl)thio]-1,3,4-thiadiazole IUPAC Name: 2-[(4-methoxyphenyl)methylsulfanyl]-5-(2-nitrophenyl)sulfanyl-1,3,4-thiadiazole Traditional Name: 2-[(2-nitrophenyl)thio]-5-(p-anisylthio)-1,3,4-thiadiazole Formula: C16H13N3O3S3 MolecularWeight: 391.48772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NN=C(S2)SC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NN=C(S2)SC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O3S3/c1-22-12-8-6-11(7-9-12)10-23-15-17-18-16(25-15)24-14-5-3-2-4-13(14)19(20)21/h2-9H,10H2,1H3