Vitas-M small molecule compound

methyl 3-chloro-6-[({2-[2-(2,3-dihydro-1H-inden-5-yloxy)propanoyl]hydrazinyl}carbonothioyl)amino]-1-benzothiophene-2-carboxylate

Catalog ID
STK457740
SMILES COC(=O)c1sc2c(c1Cl)ccc(c2)NC(=S)NNC(=O)C(Oc1ccc2c(c1)CCC2)C

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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 C23H22ClN3O4S2 MW 504.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O4S2/c1-12(31-16-8-6-13-4-3-5-14(13)10-16)21(28)26-27-23(32)25-15-7-9-17-18(11-15)33-20(19(17)24)22(29)30-2/h6-12H,3-5H2,1-2H3,(H,26,28)(H2,25,27,32)
InChIKey
GNHNAQJIYZZPCI-UHFFFAOYSA-N
Synonyms

CC(C(=O)NNC(=S)NC1=CC2=C(C=C1)C(=C(S2)C(=O)OC)Cl)OC3=CC4=C(CCC4)C=C3
InChI=1SC23H22ClN3O4S2c112(3116861343514(13)1016)21(28)262723(32)2515791718(1115)3320(19(17)24)22(29)302h612H35H212H3(H2628)(H2252732)
METHYL3CHLORO6((((2INDAN5YLOXYPROPANOYLAMINO)AMINO)THIOXOMETHYL)AMINO)BENZO(B)THIOPHENE2CARBOXYLATE
methyl3chloro6(((2(2(23dihydro1Hinden5yloxy)propanoyl)hydrazinyl)carbonothioyl)amino)1benzothiophene2carboxylate
METHYL3CHLORO6((2(23DIHYDRO1HINDEN5YLOXY)PROPANOYLAMINO)CARBAMOTHIOYLAMINO)1BENZOTHIOPHENE2CARBOXYLATE
MFCD05072527
ZINC000001121833
ZINC000001121835

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Available files

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