Vitas-M small molecule compound

N-(3,5-dimethylphenyl)-2-{[3-(furan-2-ylmethyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide

Catalog ID
STL339987
SMILES O=C(Nc1cc(C)cc(c1)C)CSc1nc2sc3c(c2c(=O)n1Cc1ccco1)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 C25H25N3O3S2 MW 479.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O3S2/c1-15-10-16(2)12-17(11-15)26-21(29)14-32-25-27-23-22(19-7-3-4-8-20(19)33-23)24(30)28(25)13-18-6-5-9-31-18/h5-6,9-12H,3-4,7-8,13-14H2,1-2H3,(H,26,29)
InChIKey
IFDCSLBAJOTQBG-UHFFFAOYSA-N
Synonyms
680992-40-9
680992409
CC1=CC(=CC(=C1)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC5=CC=CO5)C
InChI=1SC25H25N3O3S2c1151016(2)1217(1115)2621(29)143225272322(19734820(19)3323)24(30)28(25)13186593118h56912H34781314H212H3(H2629)
MFCD04015834
N(35dimethylphenyl)2((3(furan2ylmethyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(35dimethylphenyl)2((3(furan2ylmethyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
N(35dimethylphenyl)2((3(furan2ylmethyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000002438915
ZINC02438915
ZINC2438915

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Available files

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