3-[(3-methoxyphenyl)methyl]-5-[4-(4-nitrophenyl)piperazin-1-yl]-1,2,4-thiadiazole

Systemtic Name: 3-[(3-methoxyphenyl)methyl]-5-[4-(4-nitrophenyl)piperazin-1-yl]-1,2,4-thiadiazole Openeye Name: 3-[(3-methoxyphenyl)methyl]-5-[4-(4-nitrophenyl)piperazin-1-yl]-1,2,4-thiadiazole CAS Name: 3-[(3-methoxyphenyl)methyl]-5-[4-(4-nitrophenyl)-1-piperazinyl]-1,2,4-thiadiazole IUPAC Name: 3-[(3-methoxyphenyl)methyl]-5-[4-(4-nitrophenyl)piperazin-1-yl]-1,2,4-thiadiazole Traditional Name: 3-m-anisyl-5-[4-(4-nitrophenyl)piperazino]-1,2,4-thiadiazole Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC2=NSC(=N2)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)CC2=NSC(=N2)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O3S/c1-28-18-4-2-3-15(13-18)14-19-21-20(29-22-19)24-11-9-23(10-12-24)16-5-7-17(8-6-16)25(26)27/h2-8,13H,9-12,14H2,1H3