Vitas-M small molecule compound
methyl 2-({[2-(3-propoxyphenyl)quinolin-4-yl]carbonyl}amino)-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate
Catalog ID
STK422336
SMILES CCCOc1cccc(c1)c1nc2ccccc2c(c1)C(=O)Nc1sc2c(c1C(=O)OC)c1ccccc1CC2
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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 C33H28N2O4S MW 548.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H28N2O4S/c1-3-17-39-22-11-8-10-21(18-22)27-19-25(24-13-6-7-14-26(24)34-27)31(36)35-32-30(33(37)38-2)29-23-12-5-4-9-20(23)15-16-28(29)40-32/h4-14,18-19H,3,15-17H2,1-2H3,(H,35,36)InChIKey
PIFWSVBUZARRLO-UHFFFAOYSA-NSynonyms
CCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C5=C(S4)CCC6=CC=CC=C65)C(=O)OC
InChI=1SC33H28N2O4Sc131739221181021(1822)271925(2413671426(24)3427)31(36)353230(33(37)382)29231254920(23)151628(29)4032h4141819H31517H212H3(H3536)
methyl2(((2(3propoxyphenyl)quinolin4yl)carbonyl)amino)45dihydronaphtho(21b)thiophene1carboxylate
METHYL2((2(3PROPOXYPHENYL)4QUINOLYL)CARBONYLAMINO)45DIHYDROBENZO(E)BENZO(B)THIOPHENECARBOXYLATE
methyl2((2(3propoxyphenyl)quinoline4carbonyl)amino)45dihydrobenzo(e)(1)benzothiole1carboxylate
MFCD02176140
ZINC000002758576
ZINC2758576
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