2-[(4-chloranyl-2,5-dimethyl-phenyl)sulfanylmethyl]-5-(3-methyl-4-nitro-phenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(4-chloranyl-2,5-dimethyl-phenyl)sulfanylmethyl]-5-(3-methyl-4-nitro-phenyl)-1,3,4-oxadiazole Openeye Name: 2-[(4-chloro-2,5-dimethyl-phenyl)sulfanylmethyl]-5-(3-methyl-4-nitro-phenyl)-1,3,4-oxadiazole CAS Name: 2-[[(4-chloro-2,5-dimethylphenyl)thio]methyl]-5-(3-methyl-4-nitrophenyl)-1,3,4-oxadiazole IUPAC Name: 2-[(4-chloro-2,5-dimethylphenyl)sulfanylmethyl]-5-(3-methyl-4-nitrophenyl)-1,3,4-oxadiazole Traditional Name: 2-[[(4-chloro-2,5-dimethyl-phenyl)thio]methyl]-5-(3-methyl-4-nitro-phenyl)-1,3,4-oxadiazole Formula: C18H16ClN3O3S MolecularWeight: 389.85594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)SCC2=NN=C(O2)C3=CC(=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)SCC2=NN=C(O2)C3=CC(=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H16ClN3O3S/c1-10-8-16(12(3)7-14(10)19)26-9-17-20-21-18(25-17)13-4-5-15(22(23)24)11(2)6-13/h4-8H,9H2,1-3H3