Vitas-M small molecule compound
6'-amino-3'-butyl-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-2'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Catalog ID
STL052945
SMILES CCCCc1[nH]nc2c1C1(C(=C(O2)N)C#N)c2ccccc2N(C1=O)CC=C
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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 C21H21N5O2 MW 375.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2/c1-3-5-9-15-17-19(25-24-15)28-18(23)14(12-22)21(17)13-8-6-7-10-16(13)26(11-4-2)20(21)27/h4,6-8,10H,2-3,5,9,11,23H2,1H3,(H,24,25)InChIKey
IHWYIPYRCHAFBT-UHFFFAOYSA-NSynonyms
674807-64-81allyl6amino3butyl2oxo1Hspiro(indoline34pyrano(23c)pyrazole)5carbonitrile
674807648
6AMINO3BUTYL11OXO10PROP2ENYLSPIRO(4HPYRANO(32D)PYRAZOLE43INDOLINE)5CARBONITRILE
6amino3butyl2oxo1(prop2en1yl)12dihydro2Hspiro(indole34pyrano(23c)pyrazole)5carbonitrile
6AMINO3BUTYL2OXO1PROP2ENYLSPIRO(2HPYRANO(23C)PYRAZOLE43INDOLE)5CARBONITRILE
CCCCc1(nH)nc2c1C1(C(=C(O2)N)C#N)c2ccccc2N(C1=O)CC=C
CCCCC1=C2C(=NN1)OC(=C(C23C4=CC=CC=C4N(C3=O)CC=C)C#N)N
CCCCc1n(nH)c2c1C1(C(=C(O2)N)C#N)c2ccccc2N(C1=O)CC=C
InChI=1SC21H21N5O2c1359151719(252415)2818(23)14(1222)21(17)138671016(13)26(1142)20(21)27h46810H23591123H21H3(H2425)
MFCD05728130
ZINC000008568089
ZINC000008568098
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