Vitas-M small molecule compound

3,3-dimethyl-10-{[(4-methylpyrimidin-2-yl)sulfanyl]acetyl}-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK263082
SMILES Cc1ccnc(n1)SCC(=O)N1c2ccccc2NC2=C(C1c1cccs1)C(=O)CC(C2)(C)C

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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 C26H26N4O2S2 MW 490.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O2S2/c1-16-10-11-27-25(28-16)34-15-22(32)30-19-8-5-4-7-17(19)29-18-13-26(2,3)14-20(31)23(18)24(30)21-9-6-12-33-21/h4-12,24,29H,13-15H2,1-3H3
InChIKey
KSMKJGIKSBKKFX-UHFFFAOYSA-N
Synonyms
895362-40-0
33dimethyl10(((4methylpyrimidin2yl)sulfanyl)acetyl)11(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
33dimethyl10(2((4methylpyrimidin2yl)thio)acetyl)11(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
33DIMETHYL10(2(4METHYLPYRIMIDIN2YLTHIO)ACETYL)11(2THIENYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
895362400
99dimethyl5(2(4methylpyrimidin2yl)sulfanylacetyl)6thiophen2yl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1=NC(=NC=C1)SCC(=O)N2C(C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C42)C5=CC=CS5
InChI=1SC26H26N4O2S2c11610112725(2816)341522(32)3019854717(19)29181326(23)1420(31)23(18)24(30)2196123321h4122429H1315H213H3
MFCD07642556
ZINC000009483700
ZINC000009483702

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Available files

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