Vitas-M small molecule compound

11-(4-methoxyphenyl)-3,3-dimethyl-10-(thiophen-2-ylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK513682
SMILES COc1ccc(cc1)C1C2=C(Nc3c(N1C(=O)c1cccs1)cccc3)CC(CC2=O)(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 C27H26N2O3S MW 458.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O3S/c1-27(2)15-20-24(22(30)16-27)25(17-10-12-18(32-3)13-11-17)29(26(31)23-9-6-14-33-23)21-8-5-4-7-19(21)28-20/h4-14,25,28H,15-16H2,1-3H3
InChIKey
LHFMJWYWGQCIAW-UHFFFAOYSA-N
Synonyms

11(4methoxyphenyl)33dimethyl10(thiophen2ylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4methoxyphenyl)99dimethyl5(thiophene2carbonyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C4=CC=CS4)C5=CC=C(C=C5)OC)C(=O)C1)C
InChI=1SC27H26N2O3Sc127(2)152024(22(30)1627)25(17101218(323)131117)29(26(31)2396143323)21854719(21)2820h4142528H1516H213H3
MFCD13370423
ZINC000015826272
ZINC000015826276

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Available files

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