Vitas-M small molecule compound

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

Catalog ID
STK099788
SMILES COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccs1)C(=O)c1cccs1

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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 C30H26N2O4S2 MW 542.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N2O4S2/c1-35-24-12-11-18(17-25(24)36-2)19-15-21-28(23(33)16-19)29(26-9-5-13-37-26)32(30(34)27-10-6-14-38-27)22-8-4-3-7-20(22)31-21/h3-14,17,19,29,31H,15-16H2,1-2H3
InChIKey
VWOKZVKSFMFPDN-UHFFFAOYSA-N
Synonyms
523992-77-0
3(34DIMETHOXYPHENYL)11(2THIENYL)10(2THIENYLCARBONYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
3(34dimethoxyphenyl)11(thiophen2yl)10(thiophen2ylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(34dimethoxyphenyl)11(thiophen2yl)10(thiophene2carbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
523992770
9(34dimethoxyphenyl)5(thiophene2carbonyl)6thiophen2yl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
COC1=C(C=C(C=C1)C2CC3=C(C(N(C4=CC=CC=C4N3)C(=O)C5=CC=CS5)C6=CC=CS6)C(=O)C2)OC
COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccs1)C(=O)c1cccs1
InChI=1SC30H26N2O4S2c13524121118(1725(24)362)19152128(23(33)1619)29(2695133726)32(30(34)27106143827)22843720(22)3121h31417192931H1516H212H3
MFCD03488985
STK099788
ZINC000001413004
ZINC000001413007

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Available files

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