Vitas-M small molecule compound

methyl 2-({[2-(2,5-dimethoxyphenyl)quinolin-4-yl]carbonyl}amino)-5-[(2-methoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate

Catalog ID
STK423813
SMILES COc1ccc(c(c1)c1nc2ccccc2c(c1)C(=O)Nc1sc(c(c1C(=O)OC)C)C(=O)Nc1ccccc1OC)OC

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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 C33H29N3O7S MW 611.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29N3O7S/c1-18-28(33(39)43-5)32(44-29(18)31(38)35-24-12-8-9-13-27(24)42-4)36-30(37)21-17-25(34-23-11-7-6-10-20(21)23)22-16-19(40-2)14-15-26(22)41-3/h6-17H,1-5H3,(H,35,38)(H,36,37)
InChIKey
RLNJICLCZFLQLQ-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(C=CC(=C4)OC)OC)C(=O)NC5=CC=CC=C5OC
InChI=1SC33H29N3O7Sc11828(33(39)435)32(4429(18)31(38)352412891327(24)424)3630(37)211725(342311761020(21)23)221619(402)141526(22)413h617H15H3(H3538)(H3637)
methyl2(((2(25dimethoxyphenyl)quinolin4yl)carbonyl)amino)5((2methoxyphenyl)carbamoyl)4methylthiophene3carboxylate
METHYL2((2(25DIMETHOXYPHENYL)(4QUINOLYL))CARBONYLAMINO)5(N(2METHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL2((2(25DIMETHOXYPHENYL)QUINOLINE4CARBONYL)AMINO)5((2METHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD02245080
ZINC000097948888
ZINC97948888

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.