methyl (2R,4S)-6-methyl-2,4-bis(2-nitrothiophen-3-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Systemtic Name: methyl (2R,4S)-6-methyl-2,4-bis(2-nitrothiophen-3-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate Openeye Name: methyl (2R,4S)-6-methyl-2,4-bis(2-nitro-3-thienyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate CAS Name: (2R,4S)-6-methyl-2,4-bis(2-nitro-3-thiophenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (2R,4S)-6-methyl-2,4-bis(2-nitrothiophen-3-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate Traditional Name: (2R,4S)-6-methyl-2,4-bis(2-nitro-3-thienyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid methyl ester Formula: C15H14N4O6S2 MolecularWeight: 410.42486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(N1)C2=C(SC=C2)[N+](=O)[O-])C3=C(SC=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C([C@H](N[C@H](N1)C2=C(SC=C2)[N+](=O)[O-])C3=C(SC=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C15H14N4O6S2/c1-7-10(15(20)25-2)11(8-3-5-26-13(8)18(21)22)17-12(16-7)9-4-6-27-14(9)19(23)24/h3-6,11-12,16-17H,1-2H3/t11-,12+/m1/s1