ethyl 2-[2-[[1-(2-methyl-5-nitro-phenyl)sulfonylpiperidin-4-yl]carbonylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[[1-(2-methyl-5-nitro-phenyl)sulfonylpiperidin-4-yl]carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[1-(2-methyl-5-nitro-phenyl)sulfonylpiperidine-4-carbonyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[[1-(2-methyl-5-nitrophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[1-(2-methyl-5-nitrophenyl)sulfonylpiperidine-4-carbonyl]amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[1-(2-methyl-5-nitro-phenyl)sulfonylisonipecotoyl]amino]thiazol-4-yl]acetic acid ethyl ester Formula: C20H24N4O7S2 MolecularWeight: 496.55716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H24N4O7S2/c1-3-31-18(25)10-15-12-32-20(21-15)22-19(26)14-6-8-23(9-7-14)33(29,30)17-11-16(24(27)28)5-4-13(17)2/h4-5,11-12,14H,3,6-10H2,1-2H3,(H,21,22,26)