N-[5-(4-methylpiperidin-1-yl)sulfonyl-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide

Systemtic Name: N-[5-(4-methylpiperidin-1-yl)sulfonyl-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide Openeye Name: N-[5-[(4-methyl-1-piperidyl)sulfonyl]-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide CAS Name: N-[5-[(4-methyl-1-piperidinyl)sulfonyl]-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide IUPAC Name: N-[5-(4-methylpiperidin-1-yl)sulfonyl-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide Traditional Name: N-[5-(4-methylpiperidino)sulfonyl-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide Formula: C15H17N5O5S2 MolecularWeight: 411.45598

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=NN=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=NN=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O5S2/c1-10-5-7-19(8-6-10)27(24,25)15-18-17-14(26-15)16-13(21)11-3-2-4-12(9-11)20(22)23/h2-4,9-10H,5-8H2,1H3,(H,16,17,21)