Vitas-M small molecule compound
3-{[(E)-(4-methoxyphenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK743241
SMILES COc1ccc(cc1)/C=N/n1cnc2c(c1=O)c1CCCCc1s2
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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 C18H17N3O2S MW 339.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O2S/c1-23-13-8-6-12(7-9-13)10-20-21-11-19-17-16(18(21)22)14-4-2-3-5-15(14)24-17/h6-11H,2-5H2,1H3/b20-10+InChIKey
ROYBBHPMRLZJAQ-KEBDBYFISA-NSynonyms
301156-91-2(E)3((4methoxybenzylidene)amino)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3(((E)(4methoxyphenyl)methylidene)amino)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3((E)(4methoxyphenyl)methylideneamino)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
301156912
COC1=CC=C(C=C1)C=NN2C=NC3=C(C2=O)C4=C(S3)CCCC4
COc1ccc(cc1)C=Nn1cnc2c(c1=O)c1CCCCc1s2
InChI=1SC18H17N3O2Sc123138612(7913)10202111191716(18(21)22)14423515(14)2417h611H25H21H3b2010+
MFCD00705047
ZINC000004738410
ZINC1881288
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