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

Systemtic Name: N-(2-carbamimidoyl-1,2-oxazinan-5-yl)-2-[6-methyl-3-[2-(2-methylphenyl)ethylamino]-2-oxidanylidene-pyrazin-1-yl]ethanamide Openeye Name: N-(2-carbamimidoyloxazinan-5-yl)-2-[6-methyl-3-[2-(o-tolyl)ethylamino]-2-oxo-pyrazin-1-yl]acetamide CAS Name: N-(2-carbamimidoyl-5-oxazinanyl)-2-[6-methyl-3-[2-(2-methylphenyl)ethylamino]-2-oxo-1-pyrazinyl]acetamide IUPAC Name: N-(2-carbamimidoyloxazinan-5-yl)-2-[6-methyl-3-[2-(2-methylphenyl)ethylamino]-2-oxopyrazin-1-yl]acetamide Traditional Name: N-(2-amidinooxazinan-5-yl)-2-[2-keto-6-methyl-3-[2-(o-tolyl)ethylamino]pyrazin-1-yl]acetamide Formula: C21H29N7O3 MolecularWeight: 427.50006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCNC2=NC=C(N(C2=O)CC(=O)NC3CCN(OC3)C(=N)N)C

Isomeric SMILES

CC1=CC=CC=C1CCNC2=NC=C(N(C2=O)CC(=O)NC3CCN(OC3)C(=N)N)C

InChI

InChI=1S/C21H29N7O3/c1-14-5-3-4-6-16(14)7-9-24-19-20(30)27(15(2)11-25-19)12-18(29)26-17-8-10-28(21(22)23)31-13-17/h3-6,11,17H,7-10,12-13H2,1-2H3,(H3,22,23)(H,24,25)(H,26,29)