Vitas-M small molecule compound
4-fluoro-N-[(2E)-6-{[4-(2-hydroxyethyl)piperazin-1-yl]carbonyl}-1,3-benzothiazol-2(3H)-ylidene]benzenesulfonamide
Catalog ID
STK618200
SMILES OCCN1CCN(CC1)C(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)c1ccc(cc1)F)/[nH]2
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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 C20H21FN4O4S2 MW 464.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21FN4O4S2/c21-15-2-4-16(5-3-15)31(28,29)23-20-22-17-6-1-14(13-18(17)30-20)19(27)25-9-7-24(8-10-25)11-12-26/h1-6,13,26H,7-12H2,(H,22,23)InChIKey
AOWCTKRCAGVVIS-UHFFFAOYSA-NSynonyms
951957-02-14fluoroN((2E)6((4(2hydroxyethyl)piperazin1yl)carbonyl)13benzothiazol2(3H)ylidene)benzenesulfonamide
4fluoroN(6(4(2hydroxyethyl)piperazine1carbonyl)13benzothiazol2yl)benzenesulfonamide
951957021
C1CN(CCN1CCO)C(=O)C2=CC3=C(C=C2)N=C(S3)NS(=O)(=O)C4=CC=C(C=C4)F
InChI=1SC20H21FN4O4S2c21152416(5315)31(2829)232022176114(1318(17)3020)19(27)259724(81025)111226h161326H712H2(H2223)
MFCD18158744
OCCN1CCN(CC1)C(=O)c1ccc2c(c1)sc(=NS(=O)(=O)c1ccc(cc1)F)(nH)2
ZINC000013721931
ZINC13721931
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