Vitas-M small molecule compound
1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]urea
Catalog ID
STK612258
SMILES COc1cc(CCNC(=O)Nc2sc3c(c2C#N)CCCC3)ccc1OC
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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 C20H23N3O3S MW 385.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O3S/c1-25-16-8-7-13(11-17(16)26-2)9-10-22-20(24)23-19-15(12-21)14-5-3-4-6-18(14)27-19/h7-8,11H,3-6,9-10H2,1-2H3,(H2,22,23,24)InChIKey
VVOIZBAGTJOZIA-UHFFFAOYSA-NSynonyms
904500-87-41(3cyano4567tetrahydro1benzothiophen2yl)3(2(34dimethoxyphenyl)ethyl)urea
1(3cyano4567tetrahydrobenzo(b)thiophen2yl)3(34dimethoxyphenethyl)urea
904500874
COC1=C(C=C(C=C1)CCNC(=O)NC2=C(C3=C(S2)CCCC3)C#N)OC
InChI=1SC20H23N3O3Sc125168713(1117(16)262)9102220(24)231915(1221)14534618(14)2719h7811H36910H212H3(H2222324)
MFCD08284914
ZINC000006661304
ZINC06661304
ZINC6661304
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