Vitas-M small molecule compound

propyl 2-{[4-(4-chloro-2-methylphenoxy)butanoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Catalog ID
STK421626
SMILES CCCOC(=O)c1c(NC(=O)CCCOc2ccc(cc2C)Cl)sc2c1CCCCC2

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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 C24H30ClNO4S MW 464.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30ClNO4S/c1-3-13-30-24(28)22-18-8-5-4-6-9-20(18)31-23(22)26-21(27)10-7-14-29-19-12-11-17(25)15-16(19)2/h11-12,15H,3-10,13-14H2,1-2H3,(H,26,27)
InChIKey
LCDCRAVGLDOATL-UHFFFAOYSA-N
Synonyms
352677-52-2
352677522
CCCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)CCCOC3=C(C=C(C=C3)Cl)C
InChI=1SC24H30ClNO4Sc13133024(28)22188546920(18)3123(22)2621(27)107142919121117(25)1516(19)2h111215H3101314H212H3(H2627)
MFCD01340212
propyl2((4(4chloro2methylphenoxy)butanoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
propyl2(4(4chloro2methylphenoxy)butanoylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ZINC000002081761
ZINC02081761
ZINC2081761

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Available files

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