Vitas-M small molecule compound
3-[(4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL475705
SMILES O=C(N1CC2CC(C1)c1n(C2)c(=O)ccc1)Cn1cnc2c(c1=O)ccs2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H18N4O3S MW 382.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O3S/c24-16-3-1-2-15-13-6-12(8-23(15)16)7-21(9-13)17(25)10-22-11-20-18-14(19(22)26)4-5-27-18/h1-5,11-13H,6-10H2InChIKey
XZRFMEFFYCJWRO-UHFFFAOYSA-NSynonyms
3((4oxothieno(23d)pyrimidin3(4H)yl)acetyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
3(2oxo2((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)ethyl)thieno(23d)pyrimidin4(3H)one
C1C2CN(CC1C3=CC=CC(=O)N3C2)C(=O)CN4C=NC5=C(C4=O)C=CS5
InChI=1SC19H18N4O3Sc24163121513612(823(15)16)721(913)17(25)102211201814(19(22)26)452718h151113H610H2
MFCD31751299
O=C(N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)Cn1cnc2c(c1=O)ccs2
ZINC000225411190
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