Vitas-M small molecule compound
2-{[(E)-(1,2-dimethyl-1H-indol-3-yl)methylidene]amino}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Catalog ID
STL384104
SMILES O=C1N(/N=C/c2c(C)n(c3c2cccc3)C)C(=O)C2C1C1C=CC2C2C1C2
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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 C22H21N3O2 MW 359.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O2/c1-11-17(12-5-3-4-6-18(12)24(11)2)10-23-25-21(26)19-13-7-8-14(16-9-15(13)16)20(19)22(25)27/h3-8,10,13-16,19-20H,9H2,1-2H3/b23-10+InChIKey
JMKLJPSHWBKORH-AUEPDCJTSA-NSynonyms
2(((E)(12dimethyl1Hindol3yl)methylidene)amino)hexahydro46ethenocyclopropa(f)isoindole13(2H3aH)dione
CC1=C(C2=CC=CC=C2N1C)C=NN3C(=O)C4C5C=CC(C4C3=O)C6C5C6
InChI=1SC22H21N3O2c11117(12534618(12)24(11)2)10232521(26)19137814(16915(13)16)20(19)22(25)27h381013161920H9H212H3b2310+
MFCD06250334
O=C1N(N=Cc2c(C)n(c3c2cccc3)C)C(=O)C2C1C1C=CC2C2C1C2
ZINC000245226718
ZINC000245226721
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