Vitas-M small molecule compound
(2E)-N-[2-({2-oxo-2-[(1-phenylethyl)amino]ethyl}sulfanyl)-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide
Catalog ID
STK759005
SMILES O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)NC(c1ccccc1)C)/C=C/c1ccccc1
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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 C26H23N3O2S2 MW 473.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O2S2/c1-18(20-10-6-3-7-11-20)27-25(31)17-32-26-29-22-14-13-21(16-23(22)33-26)28-24(30)15-12-19-8-4-2-5-9-19/h2-16,18H,17H2,1H3,(H,27,31)(H,28,30)/b15-12+InChIKey
RXVWLKNKCJDAPQ-NTCAYCPXSA-NSynonyms
(2E)N(2((2OXO2((1PHENYLETHYL)AMINO)ETHYL)SULFANYL)13BENZOTHIAZOL6YL)3PHENYLPROP2ENAMIDE
(E)N(2(2OXO2(1PHENYLETHYLAMINO)ETHYL)SULFANYL13BENZOTHIAZOL6YL)3PHENYLPROP2ENAMIDE
CC(C1=CC=CC=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C=CC4=CC=CC=C4
InChI=1SC26H23N3O2S2c118(20106371120)2725(31)1732262922141321(1623(22)3326)2824(30)1512198425919h21618H17H21H3(H2731)(H2830)b1512+
MFCD01420384
O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)NC(c1ccccc1)C)C=Cc1ccccc1
ZINC000003667273
ZINC000003667275
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