Vitas-M small molecule compound
[(2R,3S,4S)-2-ethyl-4-[(4-iodophenyl)amino]-3-methyl-3,4-dihydroquinolin-1(2H)-yl](4-methylphenyl)methanone
Catalog ID
STK083382
SMILES CC[C@@H]1[C@@H](C)[C@H](Nc2ccc(cc2)I)c2c(N1C(=O)c1ccc(cc1)C)cccc2
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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 C26H27IN2O MW 510.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27IN2O/c1-4-23-18(3)25(28-21-15-13-20(27)14-16-21)22-7-5-6-8-24(22)29(23)26(30)19-11-9-17(2)10-12-19/h5-16,18,23,25,28H,4H2,1-3H3/t18-,23-,25+/m1/s1InChIKey
NUOOGXSNTCPIJG-MQVPCNEGSA-NSynonyms
((2R3S4S)2ETHYL4((4IODOPHENYL)AMINO)3METHYL34DIHYDROQUINOLIN1(2H)YL)(4METHYLPHENYL)METHANONE
((2R3S4S)2ethyl4(4iodoanilino)3methyl34dihydro2Hquinolin1yl)(4methylphenyl)methanone
CC(C@@H)1(C@@H)(C)(C@H)(Nc2ccc(cc2)I)c2c(N1C(=O)c1ccc(cc1)C)cccc2
CCC1C(C(C2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)C)NC4=CC=C(C=C4)I)C
InChI=1SC26H27IN2Oc142318(3)25(2821151320(27)141621)22756824(22)29(23)26(30)1911917(2)101219h51618232528H4H213H3t182325+m1s1
MFCD13368385
STK083382
ZINC000009678931
ZINC09678931
ZINC9678931
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