prop-2-enyl 2,4-dimethyl-6-[3-methyl-4-(4-nitrophenyl)sulfonyl-piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate

Systemtic Name: prop-2-enyl 2,4-dimethyl-6-[3-methyl-4-(4-nitrophenyl)sulfonyl-piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate Openeye Name: allyl 2,4-dimethyl-6-[3-methyl-4-(4-nitrophenyl)sulfonyl-piperazine-1-carbonyl]pyrimidine-5-carboxylate CAS Name: 2,4-dimethyl-6-[[3-methyl-4-(4-nitrophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-5-pyrimidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2,4-dimethyl-6-[3-methyl-4-(4-nitrophenyl)sulfonylpiperazine-1-carbonyl]pyrimidine-5-carboxylate Traditional Name: 2,4-dimethyl-6-(3-methyl-4-nosyl-piperazine-1-carbonyl)pyrimidine-5-carboxylic acid allyl ester Formula: C22H25N5O7S MolecularWeight: 503.5282

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=C(C(=NC(=N3)C)C)C(=O)OCC=C

Isomeric SMILES

CC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=C(C(=NC(=N3)C)C)C(=O)OCC=C

InChI

InChI=1S/C22H25N5O7S/c1-5-12-34-22(29)19-15(3)23-16(4)24-20(19)21(28)25-10-11-26(14(2)13-25)35(32,33)18-8-6-17(7-9-18)27(30)31/h5-9,14H,1,10-13H2,2-4H3