Vitas-M small molecule compound
4-amino-6-(2,3,4-trimethoxyphenyl)spiro[3-azabicyclo[3.1.0]hex-3-ene-2,2'-[1,3]dioxolane]-1,5-dicarbonitrile
Catalog ID
STK683399
SMILES COc1c(OC)ccc(c1OC)C1C2(C1(C#N)C(=NC12OCCO1)N)C#N
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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 C18H18N4O5 MW 370.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O5/c1-23-11-5-4-10(12(24-2)13(11)25-3)14-16(8-19)15(21)22-18(17(14,16)9-20)26-6-7-27-18/h4-5,14H,6-7H2,1-3H3,(H2,21,22)InChIKey
RYMNKCAFNMMHNN-UHFFFAOYSA-NSynonyms
2AMINO6(234TRIMETHOXYPHENYL)SPIRO(13DIOXOLANE243AZABICYCLO(310)HEX2ENE)15DICARBONITRILE
4amino6(234trimethoxyphenyl)spiro(13dioxolane223azabicyclo(310)hex3ene)15dicarbonitrile
4amino6(234trimethoxyphenyl)spiro(3azabicyclo(310)hex3ene22(13)dioxolane)15dicarbonitrile
COC1=C(C(=C(C=C1)C2C3(C2(C4(N=C3N)OCCO4)C#N)C#N)OC)OC
InChI=1SC18H18N4O5c123115410(12(242)13(11)253)1416(819)15(21)2218(17(1416)920)26672718h4514H67H213H3(H22122)
MFCD04097187
ZINC000015319214
ZINC000103010519
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