[4-[5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazol-2-yl]piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazol-2-yl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazol-2-yl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[5-(1-methyl-5-nitro-2-imidazolyl)-1,3,4-thiadiazol-2-yl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[5-(1-methyl-5-nitroimidazol-2-yl)-1,3,4-thiadiazol-2-yl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[5-(1-methyl-5-nitro-imidazol-2-yl)-1,3,4-thiadiazol-2-yl]piperazino]-phenyl-methanone Formula: C17H17N7O3S MolecularWeight: 399.42698

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1C2=NN=C(S2)N3CCN(CC3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CN=C1C2=NN=C(S2)N3CCN(CC3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H17N7O3S/c1-21-13(24(26)27)11-18-14(21)15-19-20-17(28-15)23-9-7-22(8-10-23)16(25)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3