Vitas-M small molecule compound

4-(butan-2-yloxy)-N-({4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}carbonothioyl)benzamide

Catalog ID
STK347457
SMILES CCC(Oc1ccc(cc1)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F)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 C23H25F3N4O4S MW 510.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25F3N4O4S/c1-3-15(2)34-18-7-4-16(5-8-18)21(31)27-22(35)29-12-10-28(11-13-29)19-9-6-17(23(24,25)26)14-20(19)30(32)33/h4-9,14-15H,3,10-13H2,1-2H3,(H,27,31,35)
InChIKey
PIHVMHXGVJZCDW-UHFFFAOYSA-N
Synonyms

(4(METHYLPROPOXY)PHENYL)N((4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZINYL)THIOXOMETHYL)CARBOXAMIDE
4(butan2yloxy)N((4(2nitro4(trifluoromethyl)phenyl)piperazin1yl)carbonothioyl)benzamide
4BUTAN2YLOXYN(4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZINE1CARBOTHIOYL)BENZAMIDE
CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O)
CCC(Oc1ccc(cc1)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(F)(F)F)C
InChI=1SC23H25F3N4O4Sc1315(2)34187416(5818)21(31)2722(35)29121028(111329)199617(23(2425)26)1420(19)30(32)33h491415H31013H212H3(H273135)
MFCD04093507
ZINC000012861079
ZINC000012861088

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Available files

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