Vitas-M small molecule compound
methyl 6-tert-butyl-2-({[2-(5-methylthiophen-2-yl)quinolin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK418475
SMILES COC(=O)c1c(NC(=O)c2cc(nc3c2cccc3)c2ccc(s2)C)sc2c1CCC(C2)C(C)(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 C29H30N2O3S2 MW 518.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O3S2/c1-16-10-13-23(35-16)22-15-20(18-8-6-7-9-21(18)30-22)26(32)31-27-25(28(33)34-5)19-12-11-17(29(2,3)4)14-24(19)36-27/h6-10,13,15,17H,11-12,14H2,1-5H3,(H,31,32)InChIKey
NZDQKUMWQQWIIP-UHFFFAOYSA-NSynonyms
353788-34-8353788348
CC1=CC=C(S1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C5=C(S4)CC(CC5)C(C)(C)C)C(=O)OC
InChI=1SC29H30N2O3S2c116101323(3516)221520(18867921(18)3022)26(32)312725(28(33)345)19121117(29(23)4)1424(19)3627h610131517H111214H215H3(H3132)
methyl6tertbutyl2(((2(5methylthiophen2yl)quinolin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6tertbutyl2((2(5methylthiophen2yl)quinoline4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD01835188
ZINC000002085630
ZINC000002085631
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