ethenyl N-[3-[(6S,9aS)-8-(3-methoxypropyl)-2-methyl-4,7-bis(oxidanylidene)-1-[(phenylmethyl)carbamoyl]-3,6,9,9a-tetrahydropyrazino[2,1-c][1,2,4]triazin-6-yl]propyl]carbamate

Systemtic Name: ethenyl N-[3-[(6S,9aS)-8-(3-methoxypropyl)-2-methyl-4,7-bis(oxidanylidene)-1-[(phenylmethyl)carbamoyl]-3,6,9,9a-tetrahydropyrazino[2,1-c][1,2,4]triazin-6-yl]propyl]carbamate Openeye Name: vinyl N-[3-[(6S,9aS)-1-(benzylcarbamoyl)-8-(3-methoxypropyl)-2-methyl-4,7-dioxo-3,6,9,9a-tetrahydropyrazino[2,1-c][1,2,4]triazin-6-yl]propyl]carbamate CAS Name: N-[3-[(6S,9aS)-8-(3-methoxypropyl)-2-methyl-4,7-dioxo-1-[oxo-[(phenylmethyl)amino]methyl]-3,6,9,9a-tetrahydropyrazino[2,1-c][1,2,4]triazin-6-yl]propyl]carbamic acid ethenyl ester IUPAC Name: ethenyl N-[3-[(6S,9aS)-1-(benzylcarbamoyl)-8-(3-methoxypropyl)-2-methyl-4,7-dioxo-3,6,9,9a-tetrahydropyrazino[2,1-c][1,2,4]triazin-6-yl]propyl]carbamate Traditional Name: N-[3-[(6S,9aS)-1-(benzylcarbamoyl)-4,7-diketo-8-(3-methoxypropyl)-2-methyl-3,6,9,9a-tetrahydropyrazino[2,1-c][1,2,4]triazin-6-yl]propyl]carbamic acid vinyl ester Formula: C25H36N6O6 MolecularWeight: 516.58994

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=O)N2C(N1C(=O)NCC3=CC=CC=C3)CN(C(=O)C2CCCNC(=O)OC=C)CCCOC

Isomeric SMILES

CN1CC(=O)N2[C@@H](N1C(=O)NCC3=CC=CC=C3)CN(C(=O)[C@@H]2CCCNC(=O)OC=C)CCCOC

InChI

InChI=1S/C25H36N6O6/c1-4-37-25(35)26-13-8-12-20-23(33)29(14-9-15-36-3)17-21-30(20)22(32)18-28(2)31(21)24(34)27-16-19-10-6-5-7-11-19/h4-7,10-11,20-21H,1,8-9,12-18H2,2-3H3,(H,26,35)(H,27,34)/t20-,21-/m0/s1