methyl 4-[[(2S,3S)-3-(prop-2-enylcarbamoylamino)-1-pyrazin-2-ylcarbonyl-pyrrolidin-2-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[(2S,3S)-3-(prop-2-enylcarbamoylamino)-1-pyrazin-2-ylcarbonyl-pyrrolidin-2-yl]carbonylamino]butanoate Openeye Name: methyl 4-[[(2S,3S)-3-(allylcarbamoylamino)-1-(pyrazine-2-carbonyl)pyrrolidine-2-carbonyl]amino]butanoate CAS Name: 4-[[oxo-[(2S,3S)-3-[[oxo-(prop-2-enylamino)methyl]amino]-1-[oxo(2-pyrazinyl)methyl]-2-pyrrolidinyl]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[(2S,3S)-3-(prop-2-enylcarbamoylamino)-1-(pyrazine-2-carbonyl)pyrrolidine-2-carbonyl]amino]butanoate Traditional Name: 4-[[(2S,3S)-3-(allylcarbamoylamino)-1-pyrazinoyl-prolyl]amino]butyric acid methyl ester Formula: C19H26N6O5 MolecularWeight: 418.44694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1C(CCN1C(=O)C2=NC=CN=C2)NC(=O)NCC=C

Isomeric SMILES

COC(=O)CCCNC(=O)[C@@H]1[C@H](CCN1C(=O)C2=NC=CN=C2)NC(=O)NCC=C

InChI

InChI=1S/C19H26N6O5/c1-3-7-23-19(29)24-13-6-11-25(18(28)14-12-20-9-10-21-14)16(13)17(27)22-8-4-5-15(26)30-2/h3,9-10,12-13,16H,1,4-8,11H2,2H3,(H,22,27)(H2,23,24,29)/t13-,16-/m0/s1