Vitas-M small molecule compound

N-[3-(4-chloro-2-cyclohexylphenoxy)-5-nitrophenyl]-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

Catalog ID
STK342918
SMILES Clc1ccc(c(c1)C1CCCCC1)Oc1cc(cc(c1)[N+](=O)[O-])NC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1cccs1

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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 C30H23ClF3N5O4S MW 642.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23ClF3N5O4S/c31-18-8-9-25(22(11-18)17-5-2-1-3-6-17)43-21-13-19(12-20(14-21)39(41)42)36-29(40)23-16-35-38-27(30(32,33)34)15-24(37-28(23)38)26-7-4-10-44-26/h4,7-17H,1-3,5-6H2,(H,36,40)
InChIKey
AOTNATRZOSZFBE-UHFFFAOYSA-N
Synonyms
333762-37-1
333762371
C1CCC(CC1)C2=C(C=CC(=C2)Cl)OC3=CC(=CC(=C3)(N+)(=O)(O))NC(=O)C4=C5N=C(C=C(N5N=C4)C(F)(F)F)C6=CC=CS6
Clc1ccc(c(c1)C1CCCCC1)Oc1cc(cc(c1)(N+)(=O)(O))NC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1cccs1
InChI=1SC30H23ClF3N5O4Sc31188925(22(1118)175213617)43211319(1220(1421)39(41)42)3629(40)2316353827(30(3233)34)1524(3728(23)38)2674104426h4717H1356H2(H3640)
MFCD01445111
N(3(4chloro2cyclohexylphenoxy)5nitrophenyl)5(thiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidine3carboxamide
N(3(4CHLORO2CYCLOHEXYLPHENOXY)5NITROPHENYL)5THIOPHEN2YL7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE3CARBOXAMIDE
N(5(4CHLORO2CYCLOHEXYLPHENOXY)3NITROPHENYL)(5(2THIENYL)7(TRIFLUOROMETHYL)(8HYDROPYRAZOLO(15A)PYRIMIDIN3YL))CARBOXAMIDE
ZINC000004179907
ZINC4179907

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Available files

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