5-(4-methoxyphenyl)-3-(4-nitrophenyl)-2-piperidin-1-yl-2H-1,3,4-thiadiazole

Systemtic Name: 5-(4-methoxyphenyl)-3-(4-nitrophenyl)-2-piperidin-1-yl-2H-1,3,4-thiadiazole Openeye Name: 5-(4-methoxyphenyl)-3-(4-nitrophenyl)-2-(1-piperidyl)-2H-1,3,4-thiadiazole CAS Name: 5-(4-methoxyphenyl)-3-(4-nitrophenyl)-2-(1-piperidinyl)-2H-1,3,4-thiadiazole IUPAC Name: 5-(4-methoxyphenyl)-3-(4-nitrophenyl)-2-piperidin-1-yl-2H-1,3,4-thiadiazole Traditional Name: 5-(4-methoxyphenyl)-3-(4-nitrophenyl)-2-piperidino-2H-1,3,4-thiadiazole Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(S2)N3CCCCC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(S2)N3CCCCC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O3S/c1-27-18-11-5-15(6-12-18)19-21-23(16-7-9-17(10-8-16)24(25)26)20(28-19)22-13-3-2-4-14-22/h5-12,20H,2-4,13-14H2,1H3