Vitas-M small molecule compound
methyl 6-({4-[4-(morpholin-4-ylcarbonyl)-2-nitrophenyl]piperazin-1-yl}sulfonyl)-3,4-dihydroquinoline-1(2H)-carboxylate
Catalog ID
STK272096
SMILES COC(=O)N1CCCc2c1ccc(c2)S(=O)(=O)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(=O)N1CCOCC1
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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 C26H31N5O8S MW 573.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N5O8S/c1-38-26(33)30-8-2-3-19-17-21(5-7-22(19)30)40(36,37)29-11-9-27(10-12-29)23-6-4-20(18-24(23)31(34)35)25(32)28-13-15-39-16-14-28/h4-7,17-18H,2-3,8-16H2,1H3InChIKey
WBGNVSKMHYACHD-UHFFFAOYSA-NSynonyms
COC(=O)N1CCCC2=C1C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(=O)N5CCOCC5)(N+)(=O)(O)
COC(=O)N1CCCc2c1ccc(c2)S(=O)(=O)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(=O)N1CCOCC1
InChI=1SC26H31N5O8Sc13826(33)30823191721(5722(19)30)40(3637)2911927(101229)236420(1824(23)31(34)35)25(32)28131539161428h471718H23816H21H3
methyl6((4(4(morpholin4ylcarbonyl)2nitrophenyl)piperazin1yl)sulfonyl)34dihydroquinoline1(2H)carboxylate
METHYL6(4(4(MORPHOLINE4CARBONYL)2NITROPHENYL)PIPERAZIN1YL)SULFONYL34DIHYDRO2HQUINOLINE1CARBOXYLATE
MFCD07658268
ZINC000098009021
ZINC98009021
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