Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 6-(4-tert-butylphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Catalog ID
STK405436
SMILES O=C1CC(Cc2c1c(C)c([nH]2)C(=O)OCC1CCCO1)c1ccc(cc1)C(C)(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 C25H31NO4 MW 409.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31NO4/c1-15-22-20(26-23(15)24(28)30-14-19-6-5-11-29-19)12-17(13-21(22)27)16-7-9-18(10-8-16)25(2,3)4/h7-10,17,19,26H,5-6,11-14H2,1-4H3InChIKey
QZDSLJLBKUSOLW-UHFFFAOYSA-NSynonyms
CC1=C(NC2=C1C(=O)CC(C2)C3=CC=C(C=C3)C(C)(C)C)C(=O)OCC4CCCO4
InChI=1SC25H31NO4c1152220(2623(15)24(28)30141965112919)1217(1321(22)27)167918(10816)25(23)4h710171926H561114H214H3
MFCD06651873
O=C1CC(Cc2c1c(C)c((nH)2)C(=O)OCC1CCCO1)c1ccc(cc1)C(C)(C)C
OXOLAN2YLMETHYL6(4(TERTBUTYL)PHENYL)3METHYL4OXO567TRIHYDROINDOLE2CARBOXYLATE
oxolan2ylmethyl6(4tertbutylphenyl)3methyl4oxo1567tetrahydroindole2carboxylate
tetrahydrofuran2ylmethyl6(4tertbutylphenyl)3methyl4oxo4567tetrahydro1Hindole2carboxylate
ZINC000002469511
ZINC000002469521
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