N-(2-carbamimidoyl-1,2-oxazinan-5-yl)-2-[6-methyl-2-oxidanylidene-3-(phenethylamino)pyrazin-1-yl]ethanamide

Systemtic Name: N-(2-carbamimidoyl-1,2-oxazinan-5-yl)-2-[6-methyl-2-oxidanylidene-3-(phenethylamino)pyrazin-1-yl]ethanamide Openeye Name: N-(2-carbamimidoyloxazinan-5-yl)-2-[6-methyl-2-oxo-3-(phenethylamino)pyrazin-1-yl]acetamide CAS Name: N-(2-carbamimidoyl-5-oxazinanyl)-2-[6-methyl-2-oxo-3-(phenethylamino)-1-pyrazinyl]acetamide IUPAC Name: N-(2-carbamimidoyloxazinan-5-yl)-2-[6-methyl-2-oxo-3-(phenethylamino)pyrazin-1-yl]acetamide Traditional Name: N-(2-amidinooxazinan-5-yl)-2-[2-keto-6-methyl-3-(phenethylamino)pyrazin-1-yl]acetamide Formula: C20H27N7O3 MolecularWeight: 413.47348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=O)N1CC(=O)NC2CCN(OC2)C(=N)N)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=CN=C(C(=O)N1CC(=O)NC2CCN(OC2)C(=N)N)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H27N7O3/c1-14-11-24-18(23-9-7-15-5-3-2-4-6-15)19(29)26(14)12-17(28)25-16-8-10-27(20(21)22)30-13-16/h2-6,11,16H,7-10,12-13H2,1H3,(H3,21,22)(H,23,24)(H,25,28)