Vitas-M small molecule compound
3,3-dimethyl-11-(3-methylthiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK377090
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1sccc1C
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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 C20H22N2OS MW 338.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2OS/c1-12-8-9-24-19(12)18-17-15(10-20(2,3)11-16(17)23)21-13-6-4-5-7-14(13)22-18/h4-9,18,21-22H,10-11H2,1-3H3InChIKey
WOCGAFVZZPJWGL-UHFFFAOYSA-NSynonyms
300689-11-6300689116
33dimethyl11(3methylthiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
99dimethyl6(3methylthiophen2yl)681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1=C(SC=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2
InChI=1SC20H22N2OSc112892419(12)181715(1020(23)1116(17)23)2113645714(13)2218h49182122H1011H213H3
MFCD01445321
ZINC000000179865
ZINC000000179866
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