Vitas-M small molecule compound
N-(2-ethoxyphenyl)-2-{[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL294552
SMILES CCOc1ccccc1NC(=O)CSc1nc2sc3c(c2c(=O)n1CC=C)CCCC3
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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 C23H25N3O3S2 MW 455.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O3S2/c1-3-13-26-22(28)20-15-9-5-8-12-18(15)31-21(20)25-23(26)30-14-19(27)24-16-10-6-7-11-17(16)29-4-2/h3,6-7,10-11H,1,4-5,8-9,12-14H2,2H3,(H,24,27)InChIKey
RSOVKQRSEMDJBO-UHFFFAOYSA-NSynonyms
379250-47-22((3allyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(2ethoxyphenyl)acetamide
379250472
CCOC1=CC=CC=C1NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC=C
InChI=1SC23H25N3O3S2c13132622(28)20159581218(15)3121(20)2523(26)301419(27)241610671117(16)2942h3671011H145891214H22H3(H2427)
MFCD02654863
N(2ethoxyphenyl)2((4oxo3(prop2en1yl)345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(2ethoxyphenyl)2((4oxo3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000000628563
ZINC00628563
ZINC628563
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