C=CCN(C(=O)OCc1ccccc1)c1cnc2n(c1=O)[C@H](C(=O)N(C(=O)OC(C)(C)C)c1ccccc1)C[C@@]2(C)N=[N+]=[N-]

Name: 18e

IUPAC: benzyl N-[(6S,8R)-8-azido-8-methyl-6-[(2-methylpropan-2-yl)oxycarbonyl-phenylcarbamoyl]-4-oxo-6,7-dihydropyrrolo[1,2-a]pyrimidin-3-yl]-N-prop-2-enylcarbamate

SMILES: C=CCN(C(=O)OCc1ccccc1)c1cnc2n(c1=O)[C@H](C(=O)N(C(=O)OC(C)(C)C)c1ccccc1)C[C@@]2(C)N=[N+]=[N-]

Canonical SMILES: CC1(CC(N2C1=NC=C(C2=O)N(CC=C)C(=O)OCC3=CC=CC=C3)C(=O)N(C4=CC=CC=C4)C(=O)OC(C)(C)C)N=[N+]=[N-]

Summenformel: C31H33N7O6

Molare Masse: 599.60

InChIKey: MDGFCVMHZBHUNO-GTYOFVGBSA-N

InChI:

InChI=1S/C31H33N7O6/c1-6-17-36(28(41)43-20-21-13-9-7-10-14-21)24-19-33-27-31(5,34-35-32)18-23(38(27)26(24)40)25(39)37(22-15-11-8-12-16-22)29(42)44-30(2,3)4/h6-16,19,23H,1,17-18,20H2,2-5H3/t23-,31+/m0/s1

PubChem CID: 86590670 →

Synonyme

MDGFCVMHZBHUNO-GTYOFVGBSA-N(6S,8R)-allyl-[8-azido-6-(tert-butoxycarbonyl-phenyl-aminocarbonyl)-8-methyl-4-oxo-4,6,7,8-tetrahydro-pyrrolo[1,2-a]pyrimidin-3-yl]-carbamic Acid Benzyl Ester

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