Vitas-M small molecule compound
4-methylcyclohexyl 6-(4-tert-butylphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Catalog ID
STK405404
SMILES CC1CCC(CC1)OC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)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 C27H35NO3 MW 421.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35NO3/c1-16-6-12-21(13-7-16)31-26(30)25-17(2)24-22(28-25)14-19(15-23(24)29)18-8-10-20(11-9-18)27(3,4)5/h8-11,16,19,21,28H,6-7,12-15H2,1-5H3InChIKey
NTGQTTWIUJSIJR-UHFFFAOYSA-NSynonyms
(4methylcyclohexyl)6(4tertbutylphenyl)3methyl4oxo1567tetrahydroindole2carboxylate
4METHYLCYCLOHEXYL6(4(TERTBUTYL)PHENYL)3METHYL4OXO567TRIHYDROINDOLE2CARBOXYLATE
4methylcyclohexyl6(4tertbutylphenyl)3methyl4oxo4567tetrahydro1Hindole2carboxylate
CC1CCC(CC1)OC(=O)c1(nH)c2c(c1C)C(=O)CC(C2)c1ccc(cc1)C(C)(C)C
CC1CCC(CC1)OC(=O)C2=C(C3=C(N2)CC(CC3=O)C4=CC=C(C=C4)C(C)(C)C)C
InChI=1SC27H35NO3c11661221(13716)3126(30)2517(2)2422(2825)1419(1523(24)29)1881020(11918)27(34)5h81116192128H671215H215H3
MFCD06651913
ZINC000004910751
ZINC000004910756
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