Vitas-M small molecule compound

N-(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methoxyphenyl)quinoline-4-carboxamide

Catalog ID
STK418859
SMILES COc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Nc1sc2c(c1C(=O)N)CCC(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 C30H31N3O3S MW 513.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N3O3S/c1-30(2,3)18-11-14-21-25(15-18)37-29(26(21)27(31)34)33-28(35)22-16-24(17-9-12-19(36-4)13-10-17)32-23-8-6-5-7-20(22)23/h5-10,12-13,16,18H,11,14-15H2,1-4H3,(H2,31,34)(H,33,35)
InChIKey
UULYYFJWOLWYRA-UHFFFAOYSA-N
Synonyms
354995-84-9
354995849
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)OC
InChI=1SC30H31N3O3Sc130(23)1811142125(1518)3729(26(21)27(31)34)3328(35)221624(1791219(364)131017)3223865720(22)23h51012131618H111415H214H3(H23134)(H3335)
MFCD01350138
N(6tertbutyl3carbamoyl4567tetrahydro1benzothiophen2yl)2(4methoxyphenyl)quinoline4carboxamide
ZINC000002082304
ZINC000002082305

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Available files

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