Vitas-M small molecule compound
3-[2-(3,4-dimethoxyphenyl)ethyl]-7-methyl-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK436811
SMILES COc1cc(ccc1OC)CCn1c(S)nc2c(c1=O)c1CCC(Cc1s2)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 C21H24N2O3S2 MW 416.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O3S2/c1-12-4-6-14-17(10-12)28-19-18(14)20(24)23(21(27)22-19)9-8-13-5-7-15(25-2)16(11-13)26-3/h5,7,11-12H,4,6,8-10H2,1-3H3,(H,22,27)InChIKey
HHRDLHJFYAYKQB-UHFFFAOYSA-NSynonyms
588715-20-23(2(34dimethoxyphenyl)ethyl)7methyl2sulfanyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(2(34dimethoxyphenyl)ethyl)7methyl2sulfanylidene5678tetrahydro1H(1)benzothiolo(23d)pyrimidin4one
588715202
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=S)N3)CCC4=CC(=C(C=C4)OC)OC
InChI=1SC21H24N2O3S2c112461417(1012)281918(14)20(24)23(21(27)2219)98135715(252)16(1113)263h571112H46810H213H3(H2227)
MFCD03945331
ZINC000003886689
ZINC000003886690
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