Vitas-M small molecule compound
(3aS,4R,9bR)-4-(4-tert-butylphenyl)-N-(2-fluorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide
Catalog ID
STL302207
SMILES Fc1ccccc1NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](N2)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 C28H29FN2O2S MW 476.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29FN2O2S/c1-28(2,3)19-13-11-18(12-14-19)27-22-8-6-7-21(22)23-17-20(15-16-25(23)30-27)34(32,33)31-26-10-5-4-9-24(26)29/h4-7,9-17,21-22,27,30-31H,8H2,1-3H3/t21-,22+,27+/m1/s1InChIKey
KUKPJOUNDWZZNF-VHSZZVNMSA-NSynonyms
(3aS4R9bR)4(4tertbutylphenyl)N(2fluorophenyl)3a459btetrahydro3Hcyclopenta(c)quinoline8sulfonamide
CC(C)(C)C1=CC=C(C=C1)C2C3CC=CC3C4=C(N2)C=CC(=C4)S(=O)(=O)NC5=CC=CC=C5F
Fc1ccccc1NS(=O)(=O)c1ccc2c(c1)(C@@H)1C=CC(C@@H)1(C@@H)(N2)c1ccc(cc1)C(C)(C)C
InChI=1SC28H29FN2O2Sc128(23)19131118(121419)272286721(22)231720(151625(23)3027)34(3233)31261054924(26)29h479172122273031H8H213H3t2122+27+m1s1
ZINC000014166057
ZINC14166057
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