Vitas-M small molecule compound

1-[4-(benzyloxy)-3-methoxyphenyl]-7-chloro-2-(5-methyl-1,3,4-thiadiazol-2-yl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

Catalog ID
STL342357
SMILES COc1cc(ccc1OCc1ccccc1)C1N(c2nnc(s2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

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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 C28H20ClN3O5S MW 546.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20ClN3O5S/c1-15-30-31-28(38-15)32-24(23-25(33)19-13-18(29)9-11-20(19)37-26(23)27(32)34)17-8-10-21(22(12-17)35-2)36-14-16-6-4-3-5-7-16/h3-13,24H,14H2,1-2H3
InChIKey
RUIZMIITXFQVFH-UHFFFAOYSA-N
Synonyms
630086-72-5
1(4(benzyloxy)3methoxyphenyl)7chloro2(5methyl134thiadiazol2yl)12dihydrochromeno(23c)pyrrole39dione
630086725
7CHLORO1(3METHOXY4PHENYLMETHOXYPHENYL)2(5METHYL134THIADIAZOL2YL)1HCHROMENO(23C)PYRROLE39DIONE
CC1=NN=C(S1)N2C(C3=C(C2=O)OC4=C(C3=O)C=C(C=C4)Cl)C5=CC(=C(C=C5)OCC6=CC=CC=C6)OC
InChI=1SC28H20ClN3O5Sc115303128(3815)3224(2325(33)191318(29)91120(19)3726(23)27(32)34)1781021(22(1217)352)3614166435716h31324H14H212H3
MFCD04154318
ZINC000002399616
ZINC000002399617

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Available files

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