Vitas-M small molecule compound

6-chloro-N-[(2Z)-5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-7-methyl-4-oxo-4H-chromene-2-carboxamide

Catalog ID
STK575706
SMILES Clc1ccc(cc1)CSc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)cc(c(c3)Cl)C)/s1

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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 C20H13Cl2N3O3S2 MW 478.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13Cl2N3O3S2/c1-10-6-16-13(7-14(10)22)15(26)8-17(28-16)18(27)23-19-24-25-20(30-19)29-9-11-2-4-12(21)5-3-11/h2-8H,9H2,1H3,(H,23,24,27)
InChIKey
YJIYKFVMHYKOEB-UHFFFAOYSA-N
Synonyms
873080-93-4
6chloroN((2Z)5((4chlorobenzyl)sulfanyl)134thiadiazol2(3H)ylidene)7methyl4oxo4Hchromene2carboxamide
CC1=C(C=C2C(=C1)OC(=CC2=O)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)Cl)Cl
Clc1ccc(cc1)CSc1n(nH)c(=NC(=O)c2cc(=O)c3c(o2)cc(c(c3)Cl)C)s1
InChI=1SC20H13Cl2N3O3S2c11061613(714(10)22)15(26)817(2816)18(27)2319242520(3019)299112412(21)5311h28H9H21H3(H232427)
MFCD07201040
ZINC000009348570

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Available files

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