2-(4-butoxyphenyl)-5-(4-nitrophenyl)-1,3,4-thiadiazole

Systemtic Name: 2-(4-butoxyphenyl)-5-(4-nitrophenyl)-1,3,4-thiadiazole Openeye Name: 2-(4-butoxyphenyl)-5-(4-nitrophenyl)-1,3,4-thiadiazole CAS Name: 2-(4-butoxyphenyl)-5-(4-nitrophenyl)-1,3,4-thiadiazole IUPAC Name: 2-(4-butoxyphenyl)-5-(4-nitrophenyl)-1,3,4-thiadiazole Traditional Name: 2-(4-butoxyphenyl)-5-(4-nitrophenyl)-1,3,4-thiadiazole Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3S/c1-2-3-12-24-16-10-6-14(7-11-16)18-20-19-17(25-18)13-4-8-15(9-5-13)21(22)23/h4-11H,2-3,12H2,1H3