5-(2-chloranyl-4-methoxy-phenyl)-N-[(3R,4S)-4-ethoxy-1-pyrimidin-2-yl-pyrrolidin-3-yl]-3,6-diethyl-pyrazin-2-amine

Systemtic Name: 5-(2-chloranyl-4-methoxy-phenyl)-N-[(3R,4S)-4-ethoxy-1-pyrimidin-2-yl-pyrrolidin-3-yl]-3,6-diethyl-pyrazin-2-amine Openeye Name: 5-(2-chloro-4-methoxy-phenyl)-N-[(3R,4S)-4-ethoxy-1-pyrimidin-2-yl-pyrrolidin-3-yl]-3,6-diethyl-pyrazin-2-amine CAS Name: 5-(2-chloro-4-methoxyphenyl)-N-[(3R,4S)-4-ethoxy-1-(2-pyrimidinyl)-3-pyrrolidinyl]-3,6-diethyl-2-pyrazinamine IUPAC Name: 5-(2-chloro-4-methoxyphenyl)-N-[(3R,4S)-4-ethoxy-1-pyrimidin-2-ylpyrrolidin-3-yl]-3,6-diethylpyrazin-2-amine Traditional Name: [5-(2-chloro-4-methoxy-phenyl)-3,6-diethyl-pyrazin-2-yl]-[(3R,4S)-4-ethoxy-1-(2-pyrimidyl)pyrrolidin-3-yl]amine Formula: C25H31ClN6O2 MolecularWeight: 483.00564

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(C(=N1)NC2CN(CC2OCC)C3=NC=CC=N3)CC)C4=C(C=C(C=C4)OC)Cl

Isomeric SMILES

CCC1=C(N=C(C(=N1)N[C@@H]2CN(C[C@@H]2OCC)C3=NC=CC=N3)CC)C4=C(C=C(C=C4)OC)Cl

InChI

InChI=1S/C25H31ClN6O2/c1-5-19-23(17-10-9-16(33-4)13-18(17)26)29-20(6-2)24(30-19)31-21-14-32(15-22(21)34-7-3)25-27-11-8-12-28-25/h8-13,21-22H,5-7,14-15H2,1-4H3,(H,30,31)/t21-,22+/m1/s1