Vitas-M small molecule compound
N-{2-[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]ethyl}-1-(4-fluorophenyl)-5-phenyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL441203
SMILES Fc1ccc(cc1)n1nnc(c1c1ccccc1)C(=O)NCCC1C(C1(C)C)c1c(C)[nH]c2c1cccc2
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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 C31H30FN5O MW 507.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30FN5O/c1-19-26(23-11-7-8-12-25(23)34-19)27-24(31(27,2)3)17-18-33-30(38)28-29(20-9-5-4-6-10-20)37(36-35-28)22-15-13-21(32)14-16-22/h4-16,24,27,34H,17-18H2,1-3H3,(H,33,38)InChIKey
LBKNXRUUNWYRND-UHFFFAOYSA-NSynonyms
CC1=C(C2=CC=CC=C2N1)C3C(C3(C)C)CCNC(=O)C4=C(N(N=N4)C5=CC=C(C=C5)F)C6=CC=CC=C6
Fc1ccc(cc1)n1nnc(c1c1ccccc1)C(=O)NCCC1C(C1(C)C)c1c(C)(nH)c2c1cccc2
InChI=1SC31H30FN5Oc11926(2311781225(23)3419)2724(31(272)3)17183330(38)2829(2095461020)37(363528)22151321(32)141622h416242734H1718H213H3(H3338)
MFCD07773685
N(2(22dimethyl3(2methyl1Hindol3yl)cyclopropyl)ethyl)1(4fluorophenyl)5phenyl1H123triazole4carboxamide
N(2(22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)ETHYL)1(4FLUOROPHENYL)5PHENYLTRIAZOLE4CARBOXAMIDE
ZINC000003765635
ZINC000003765638
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