Vitas-M small molecule compound

4-(phenylsulfonyl)-N-[4-(propan-2-yl)phenyl]piperazine-1-carbothioamide

Catalog ID
STK494017
SMILES CC(c1ccc(cc1)NC(=S)N1CCN(CC1)S(=O)(=O)c1ccccc1)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 C20H25N3O2S2 MW 403.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O2S2/c1-16(2)17-8-10-18(11-9-17)21-20(26)22-12-14-23(15-13-22)27(24,25)19-6-4-3-5-7-19/h3-11,16H,12-15H2,1-2H3,(H,21,26)
InChIKey
LXGIMLJYYIRCHJ-UHFFFAOYSA-N
Synonyms

4(((4(METHYLETHYL)PHENYL)AMINO)THIOXOMETHYL)1(PHENYLSULFONYL)PIPERAZINE
4(BENZENESULFONYL)N(4PROPAN2YLPHENYL)PIPERAZINE1CARBOTHIOAMIDE
4(phenylsulfonyl)N(4(propan2yl)phenyl)piperazine1carbothioamide
CC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
InChI=1SC20H25N3O2S2c116(2)1781018(11917)2120(26)22121423(151322)27(2425)196435719h31116H1215H212H3(H2126)
MFCD06077496
ZINC000007560876
ZINC07560876
ZINC7560876

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Available files

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