Vitas-M small molecule compound

5-(3,4-dimethoxyphenyl)-2-(prop-2-en-1-yl)-3-thioxo-2,3,5,6,11,11a-hexahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-1-one

Catalog ID
STL168753
SMILES C=CCN1C(=O)C2N(C1=S)C(c1ccc(c(c1)OC)OC)c1c(C2)c2ccccc2[nH]1

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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 C24H23N3O3S MW 433.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O3S/c1-4-11-26-23(28)18-13-16-15-7-5-6-8-17(15)25-21(16)22(27(18)24(26)31)14-9-10-19(29-2)20(12-14)30-3/h4-10,12,18,22,25H,1,11,13H2,2-3H3
InChIKey
VYWBJMZESRVWOD-UHFFFAOYSA-N
Synonyms
1094606-38-8
(11aS)2allyl5(34dimethoxyphenyl)3thioxo23561111ahexahydro1Himidazo(1516)pyrido(34b)indol1one
1094606388
2allyl10(34dimethoxyphenyl)1thioxo3a4910tetrahydroimidazo(15b)$bcarbolin3one
5(34dimethoxyphenyl)2(prop2en1yl)3thioxo23561111ahexahydro1Himidazo(1516)pyrido(34b)indol1one
C=CCN1C(=O)(C@H)2N(C1=S)C(c1ccc(c(c1)OC)OC)c1c(C2)c2ccccc2(nH)1
C=CCN1C(=O)C2N(C1=S)C(c1ccc(c(c1)OC)OC)c1c(C2)c2ccccc2(nH)1
COC1=C(C=C(C=C1)C2C3=C(CC4N2C(=S)N(C4=O)CC=C)C5=CC=CC=C5N3)OC
InChI=1SC24H23N3O3Sc14112623(28)18131615756817(15)2521(16)22(27(18)24(26)31)1491019(292)20(1214)303h41012182225H11113H223H3
MFCD04055674
ZINC000002090667
ZINC000002730297

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Available files

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