Vitas-M small molecule compound

N-{2-[(3-methylbenzyl)sulfanyl]ethyl}-N~2~-(phenylsulfonyl)-N~2~-[4-(propan-2-yl)phenyl]glycinamide

Catalog ID
STK007602
SMILES O=C(CN(S(=O)(=O)c1ccccc1)c1ccc(cc1)C(C)C)NCCSCc1cccc(c1)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 C27H32N2O3S2 MW 496.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O3S2/c1-21(2)24-12-14-25(15-13-24)29(34(31,32)26-10-5-4-6-11-26)19-27(30)28-16-17-33-20-23-9-7-8-22(3)18-23/h4-15,18,21H,16-17,19-20H2,1-3H3,(H,28,30)
InChIKey
TWFGEDRGPAHHCD-UHFFFAOYSA-N
Synonyms

2(4ISOPROPYL(PHENYLSULFONYL)ANILINO)N(2((3METHYLBENZYL)SULFANYL)ETHYL)ACETAMIDE
2(N(BENZENESULFONYL)4PROPAN2YLANILINO)N(2((3METHYLPHENYL)METHYLSULFANYL)ETHYL)ACETAMIDE
CC1=CC(=CC=C1)CSCCNC(=O)CN(C2=CC=C(C=C2)C(C)C)S(=O)(=O)C3=CC=CC=C3
InChI=1SC27H32N2O3S2c121(2)24121425(151324)29(34(3132)26105461126)1927(30)28161733202397822(3)1823h4151821H16171920H213H3(H2830)
MFCD03068823
N(2((3methylbenzyl)sulfanyl)ethyl)N~2~(phenylsulfonyl)N~2~(4(propan2yl)phenyl)glycinamide
N(2((3METHYLBENZYL)SULFANYL)ETHYL)N2(PHENYLSULFONYL)N2(4(PROPAN2YL)PHENYL)GLYCINAMIDE
O=C(CN(S(=O)(=O)c1ccccc1)c1ccc(cc1)C(C)C)NCCSCc1cccc(c1)C
STK007602
ZINC000002089127
ZINC02089127
ZINC2089127

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.