Vitas-M small molecule compound
6-(4-benzylphenyl)-6,12-dihydro-5H-benzo[b]indeno[1,2-e][1,4]thiazepin-5-one
Catalog ID
STK209943
SMILES O=C1c2ccccc2C2=C1C(Sc1c(N2)cccc1)c1ccc(cc1)Cc1ccccc1
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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 C29H21NOS MW 431.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21NOS/c31-28-23-11-5-4-10-22(23)27-26(28)29(32-25-13-7-6-12-24(25)30-27)21-16-14-20(15-17-21)18-19-8-2-1-3-9-19/h1-17,29-30H,18H2InChIKey
XKKXPGMMSLTORG-UHFFFAOYSA-NSynonyms
11(4BENZYLPHENYL)511DIHYDROINDENO(21C)(15)BENZOTHIAZEPIN12ONE
11(4BENZYLPHENYL)5H11HBENZO(B)INDENO(32E)14THIAZEPIN12ONE
6(4benzylphenyl)612dihydro5Hbenzo(b)indeno(12e)(14)thiazepin5one
C1=CC=C(C=C1)CC2=CC=C(C=C2)C3C4=C(C5=CC=CC=C5C4=O)NC6=CC=CC=C6S3
InChI=1SC29H21NOSc31282311541022(23)2726(28)29(322513761224(25)3027)21161420(151721)18198213919h1172930H18H2
MFCD05843670
ZINC000002205721
ZINC000002205724
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