Vitas-M small molecule compound

propan-2-yl 2-({(2E)-2-cyano-3-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]prop-2-enoyl}amino)thiophene-3-carboxylate

Catalog ID
STK474012
SMILES N#C/C(=C\c1ccc(c(c1)CN1CCSCC1)OC)/C(=O)Nc1sccc1C(=O)OC(C)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 C24H27N3O4S2 MW 485.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O4S2/c1-16(2)31-24(29)20-6-9-33-23(20)26-22(28)18(14-25)12-17-4-5-21(30-3)19(13-17)15-27-7-10-32-11-8-27/h4-6,9,12-13,16H,7-8,10-11,15H2,1-3H3,(H,26,28)/b18-12+
InChIKey
POGBZSFTKAKTKN-LDADJPATSA-N
Synonyms

CC(C)OC(=O)C1=C(SC=C1)NC(=O)C(=CC2=CC(=C(C=C2)OC)CN3CCSCC3)C#N
InChI=1SC24H27N3O4S2c116(2)3124(29)20693323(20)2622(28)18(1425)12174521(303)19(1317)15277103211827h469121316H78101115H213H3(H2628)b1812+
METHYLETHYL2((2E)2CYANO3(4METHOXY3(14THIAZAPERHYDROIN4YLMETHYL)PHENYL)PROP2ENOYLAMINO)THIOPHENE3CARBOXYLATE
MFCD07080492
N#CC(=Cc1ccc(c(c1)CN1CCSCC1)OC)C(=O)Nc1sccc1C(=O)OC(C)C
propan2yl2(((2E)2cyano3(4methoxy3(thiomorpholin4ylmethyl)phenyl)prop2enoyl)amino)thiophene3carboxylate
propan2yl2(((E)2cyano3(4methoxy3(thiomorpholin4ylmethyl)phenyl)prop2enoyl)amino)thiophene3carboxylate
ZINC000020549845
ZINC20549845

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Available files

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