Vitas-M small molecule compound

methyl 1-({2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)amino]phenyl}sulfonyl)prolinate

Catalog ID
STK737431
SMILES COC(=O)C1CCCN1S(=O)(=O)c1ccccc1NC(=O)C12CC3CC(C2)CC(C1)C3

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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 C23H30N2O5S MW 446.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N2O5S/c1-30-21(26)19-6-4-8-25(19)31(28,29)20-7-3-2-5-18(20)24-22(27)23-12-15-9-16(13-23)11-17(10-15)14-23/h2-3,5,7,15-17,19H,4,6,8-14H2,1H3,(H,24,27)
InChIKey
XTCUNAJFSAWWKK-UHFFFAOYSA-N
Synonyms

COC(=O)C1CCCN1S(=O)(=O)C2=CC=CC=C2NC(=O)C34CC5CC(C3)CC(C5)C4
InChI=1SC23H30N2O5Sc13021(26)1964825(19)31(2829)20732518(20)2422(27)231215916(1323)1117(1015)1423h2357151719H46814H21H3(H2427)
METHYL1((2((1ADAMANTYLCARBONYL)AMINO)PHENYL)SULFONYL)2PYRROLIDINECARBOXYLATE
methyl1((2((tricyclo(3311~37~)dec1ylcarbonyl)amino)phenyl)sulfonyl)prolinate
METHYL1(2(ADAMANTANE1CARBONYLAMINO)PHENYL)SULFONYLPYRROLIDINE2CARBOXYLATE
MFCD07022370
ZINC000012417558
ZINC000012417560

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Available files

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