3-cyclopropyl-5-[1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]ethyl]-1,2,4-oxadiazole

Systemtic Name: 3-cyclopropyl-5-[1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]ethyl]-1,2,4-oxadiazole Openeye Name: 3-cyclopropyl-5-[1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]ethyl]-1,2,4-oxadiazole CAS Name: 3-cyclopropyl-5-[1-[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]ethyl]-1,2,4-oxadiazole IUPAC Name: 3-cyclopropyl-5-[1-[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]ethyl]-1,2,4-oxadiazole Traditional Name: 3-cyclopropyl-5-[1-[4-(4-mesyl-2-nitro-phenyl)piperazino]ethyl]-1,2,4-oxadiazole Formula: C18H23N5O5S MolecularWeight: 421.47072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NO1)C2CC2)N3CCN(CC3)C4=C(C=C(C=C4)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(C1=NC(=NO1)C2CC2)N3CCN(CC3)C4=C(C=C(C=C4)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O5S/c1-12(18-19-17(20-28-18)13-3-4-13)21-7-9-22(10-8-21)15-6-5-14(29(2,26)27)11-16(15)23(24)25/h5-6,11-13H,3-4,7-10H2,1-2H3