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N-(2-{[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide

Catalog ID
STK676253
SMILES O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)N1CCc2c1cccc2)CSc1nc2sc3c(c2c(=O)n1C)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 C30H27N5O3S4 MW 633.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N5O3S4/c1-34-28(38)26-19-7-3-5-9-22(19)41-27(26)33-29(34)39-15-24(36)31-18-10-11-20-23(14-18)42-30(32-20)40-16-25(37)35-13-12-17-6-2-4-8-21(17)35/h2,4,6,8,10-11,14H,3,5,7,9,12-13,15-16H2,1H3,(H,31,36)
InChIKey
FGNSYQWBMDWGGZ-UHFFFAOYSA-N
Synonyms

CN1C(=O)C2=C(N=C1SCC(=O)NC3=CC4=C(C=C3)N=C(S4)SCC(=O)N5CCC6=CC=CC=C65)SC7=C2CCCC7
InChI=1SC30H27N5O3S4c13428(38)2619735922(19)4127(26)3329(34)391524(36)311810112023(1418)4230(3220)401625(37)35131217624821(17)35h2468101114H357912131516H21H3(H3136)
MFCD01872774
N(2((2(23dihydro1Hindol1yl)2oxoethyl)sulfanyl)13benzothiazol6yl)2((3methyl4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(2((2(indolin1yl)2oxoethyl)thio)benzo(d)thiazol6yl)2((3methyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
N(2(2(23dihydroindol1yl)2oxoethyl)sulfanyl13benzothiazol6yl)2((3methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000033354241
ZINC33354241

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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