4-methyl-3-nitro-N-[2-oxidanylidene-2-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]ethyl]benzamide

Systemtic Name: 4-methyl-3-nitro-N-[2-oxidanylidene-2-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]ethyl]benzamide Openeye Name: 4-methyl-3-nitro-N-[2-oxo-2-[4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]ethyl]benzamide CAS Name: 4-methyl-3-nitro-N-[2-oxo-2-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1-piperazinyl]ethyl]benzamide IUPAC Name: 4-methyl-3-nitro-N-[2-oxo-2-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]ethyl]benzamide Traditional Name: N-[2-keto-2-[4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazino]ethyl]-4-methyl-3-nitro-benzamide Formula: C21H22N6O5S MolecularWeight: 470.50158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCN(CC2)CC3=NC(=NO3)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCN(CC2)CC3=NC(=NO3)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N6O5S/c1-14-4-5-15(11-16(14)27(30)31)21(29)22-12-19(28)26-8-6-25(7-9-26)13-18-23-20(24-32-18)17-3-2-10-33-17/h2-5,10-11H,6-9,12-13H2,1H3,(H,22,29)