Vitas-M small molecule compound

6'-amino-1-(naphthalen-1-ylmethyl)-2-oxo-3'-phenyl-1,2-dihydro-2'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile

Catalog ID
STL049524
SMILES N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)Cc1cccc3c1cccc3)c([nH]n2)c1ccccc1

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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 C31H21N5O2 MW 495.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H21N5O2/c32-17-24-28(33)38-29-26(27(34-35-29)20-10-2-1-3-11-20)31(24)23-15-6-7-16-25(23)36(30(31)37)18-21-13-8-12-19-9-4-5-14-22(19)21/h1-16H,18,33H2,(H,34,35)
InChIKey
OJRGZMJOCCUGLB-UHFFFAOYSA-N
Synonyms
845662-07-9
6amino1(naphthalen1ylmethyl)2oxo3phenyl12dihydro2Hspiro(indole34pyrano(23c)pyrazole)5carbonitrile
6amino1(naphthalen1ylmethyl)2oxo3phenyl1Hspiro(indoline34pyrano(23c)pyrazole)5carbonitrile
6AMINO1(NAPHTHALEN1YLMETHYL)2OXO3PHENYLSPIRO(2HPYRANO(23C)PYRAZOLE43INDOLE)5CARBONITRILE
845662079
C1=CC=C(C=C1)C2=C3C(=NN2)OC(=C(C34C5=CC=CC=C5N(C4=O)CC6=CC=CC7=CC=CC=C76)C#N)N
InChI=1SC31H21N5O2c32172428(33)382926(27(343529)20102131120)31(24)2315671625(23)36(30(31)37)182113812199451422(19)21h116H1833H2(H3435)
MFCD05730402
N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)Cc1cccc3c1cccc3)c((nH)n2)c1ccccc1
N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)Cc1cccc3c1cccc3)c(n(nH)2)c1ccccc1
ZINC000009281664
ZINC000009282213

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Available files

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