Vitas-M small molecule compound
6-(4-methylphenyl)-6H-benzo[b]indeno[1,2-e][1,4]thiazepin-5-yl acetate
Catalog ID
STK395212
SMILES Cc1ccc(cc1)C1Sc2ccccc2N=C2C1=C(OC(=O)C)c1c2cccc1
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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 C25H19NO2S MW 397.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19NO2S/c1-15-11-13-17(14-12-15)25-22-23(26-20-9-5-6-10-21(20)29-25)18-7-3-4-8-19(18)24(22)28-16(2)27/h3-14,25H,1-2H3InChIKey
DNKAEXBDKZTDKM-UHFFFAOYSA-NSynonyms
(11(4METHYLPHENYL)11HINDENO(23C)(15)BENZOTHIAZEPIN12YL)ACETATE
11(4METHYLPHENYL)11HBENZO(B)INDENO(12E)14THIAZEPIN12YLACETATE
6(4METHYLPHENYL)6HBENZO(B)INDENO(12E)(14)THIAZEPIN5YLACETATE
CC1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4C3=NC5=CC=CC=C5S2)OC(=O)C
InChI=1SC25H19NO2Sc115111317(141215)252223(26209561021(20)2925)18734819(18)24(22)2816(2)27h31425H12H3
MFCD01824989
ZINC000004501673
ZINC000004501674
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