2-cyclopentyl-5-[1-(2-methyl-5-nitro-phenyl)sulfonylpiperidin-3-yl]-1,3,4-thiadiazole

Systemtic Name: 2-cyclopentyl-5-[1-(2-methyl-5-nitro-phenyl)sulfonylpiperidin-3-yl]-1,3,4-thiadiazole Openeye Name: 2-cyclopentyl-5-[1-(2-methyl-5-nitro-phenyl)sulfonyl-3-piperidyl]-1,3,4-thiadiazole CAS Name: 2-cyclopentyl-5-[1-(2-methyl-5-nitrophenyl)sulfonyl-3-piperidinyl]-1,3,4-thiadiazole IUPAC Name: 2-cyclopentyl-5-[1-(2-methyl-5-nitrophenyl)sulfonylpiperidin-3-yl]-1,3,4-thiadiazole Traditional Name: 2-cyclopentyl-5-[1-(2-methyl-5-nitro-phenyl)sulfonyl-3-piperidyl]-1,3,4-thiadiazole Formula: C19H24N4O4S2 MolecularWeight: 436.54826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCCC(C2)C3=NN=C(S3)C4CCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCCC(C2)C3=NN=C(S3)C4CCCC4

InChI

InChI=1S/C19H24N4O4S2/c1-13-8-9-16(23(24)25)11-17(13)29(26,27)22-10-4-7-15(12-22)19-21-20-18(28-19)14-5-2-3-6-14/h8-9,11,14-15H,2-7,10,12H2,1H3