2-(3-nitrophenyl)-5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,3,4-oxadiazole

Systemtic Name: 2-(3-nitrophenyl)-5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,3,4-oxadiazole Openeye Name: 2-[(4-isopropylphenyl)methylsulfanyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole CAS Name: 2-(3-nitrophenyl)-5-[(4-propan-2-ylphenyl)methylthio]-1,3,4-oxadiazole IUPAC Name: 2-(3-nitrophenyl)-5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,3,4-oxadiazole Traditional Name: 2-[(4-isopropylbenzyl)thio]-5-(3-nitrophenyl)-1,3,4-oxadiazole Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CSC2=NN=C(O2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CSC2=NN=C(O2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3S/c1-12(2)14-8-6-13(7-9-14)11-25-18-20-19-17(24-18)15-4-3-5-16(10-15)21(22)23/h3-10,12H,11H2,1-2H3