ethyl (3R,4S)-3-[[5-(2-chloranyl-4-methoxy-phenyl)-3-ethyl-1-methyl-6-oxidanylidene-pyrazin-2-yl]amino]-4-ethoxy-pyrrolidine-1-carboxylate

Systemtic Name: ethyl (3R,4S)-3-[[5-(2-chloranyl-4-methoxy-phenyl)-3-ethyl-1-methyl-6-oxidanylidene-pyrazin-2-yl]amino]-4-ethoxy-pyrrolidine-1-carboxylate Openeye Name: ethyl (3R,4S)-3-[[5-(2-chloro-4-methoxy-phenyl)-3-ethyl-1-methyl-6-oxo-pyrazin-2-yl]amino]-4-ethoxy-pyrrolidine-1-carboxylate CAS Name: (3R,4S)-3-[[5-(2-chloro-4-methoxyphenyl)-3-ethyl-1-methyl-6-oxo-2-pyrazinyl]amino]-4-ethoxy-1-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R,4S)-3-[[5-(2-chloro-4-methoxyphenyl)-3-ethyl-1-methyl-6-oxopyrazin-2-yl]amino]-4-ethoxypyrrolidine-1-carboxylate Traditional Name: (3R,4S)-3-[[5-(2-chloro-4-methoxy-phenyl)-3-ethyl-6-keto-1-methyl-pyrazin-2-yl]amino]-4-ethoxy-pyrrolidine-1-carboxylic acid ethyl ester Formula: C23H31ClN4O5 MolecularWeight: 478.96904

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=O)C(=N1)C2=C(C=C(C=C2)OC)Cl)C)NC3CN(CC3OCC)C(=O)OCC

Isomeric SMILES

CCC1=C(N(C(=O)C(=N1)C2=C(C=C(C=C2)OC)Cl)C)N[C@@H]3CN(C[C@@H]3OCC)C(=O)OCC

InChI

InChI=1S/C23H31ClN4O5/c1-6-17-21(26-18-12-28(23(30)33-8-3)13-19(18)32-7-2)27(4)22(29)20(25-17)15-10-9-14(31-5)11-16(15)24/h9-11,18-19,26H,6-8,12-13H2,1-5H3/t18-,19+/m1/s1