Vitas-M small molecule compound
3-amino-2-(4-butoxyphenyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK053766
SMILES CCCCOc1ccc(cc1)c1nc2sc3c(c2c(=O)n1N)CC(OC3)(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 C21H25N3O3S MW 399.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O3S/c1-4-5-10-26-14-8-6-13(7-9-14)18-23-19-17(20(25)24(18)22)15-11-21(2,3)27-12-16(15)28-19/h6-9H,4-5,10-12,22H2,1-3H3InChIKey
WAHKKWGBXFOCSX-UHFFFAOYSA-NSynonyms
3amino2(4butoxyphenyl)66dimethyl3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
3amino2(4butoxyphenyl)66dimethyl58dihydropyrano(23)thieno(24b)pyrimidin4one
CCCCOC1=CC=C(C=C1)C2=NC3=C(C4=C(S3)COC(C4)(C)C)C(=O)N2N
CCCCOc1ccc(cc1)c1nc2sc3c(c2c(=O)n1N)CC(OC3)(C)C
InChI=1SC21H25N3O3Sc1451026148613(7914)18231917(20(25)24(18)22)151121(23)271216(15)2819h69H45101222H213H3
MFCD01561358
STK053766
ZINC000005713218
ZINC05713218
ZINC5713218
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