Vitas-M small molecule compound
4-{(1Z)-2-{[(2-chlorophenyl)carbonyl]amino}-3-[(furan-2-ylmethyl)amino]-3-oxoprop-1-en-1-yl}phenyl 4-methylbenzenesulfonate
Catalog ID
STK381948
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)/C=C(/C(=O)NCc1ccco1)\NC(=O)c1ccccc1Cl
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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 C28H23ClN2O6S MW 551.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23ClN2O6S/c1-19-8-14-23(15-9-19)38(34,35)37-21-12-10-20(11-13-21)17-26(28(33)30-18-22-5-4-16-36-22)31-27(32)24-6-2-3-7-25(24)29/h2-17H,18H2,1H3,(H,30,33)(H,31,32)/b26-17-InChIKey
UBGSAKMWXLUJFZ-ONUIUJJFSA-NSynonyms
(4((Z)2((2chlorobenzoyl)amino)3(furan2ylmethylamino)3oxoprop1enyl)phenyl)4methylbenzenesulfonate
4((1Z)2(((2chlorophenyl)carbonyl)amino)3((furan2ylmethyl)amino)3oxoprop1en1yl)phenyl4methylbenzenesulfonate
4((1Z)2((2CHLOROPHENYL)CARBONYLAMINO)2(N(2FURYLMETHYL)CARBAMOYL)VINYL)PHENYL4METHYLBENZENESULFONATE
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=C(C(=O)NCC3=CC=CO3)NC(=O)C4=CC=CC=C4Cl
Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)C=C(C(=O)NCc1ccco1)NC(=O)c1ccccc1Cl
InChI=1SC28H23ClN2O6Sc11981423(15919)38(3435)3721121020(111321)1726(28(33)30182254163622)3127(32)24623725(24)29h217H18H21H3(H3033)(H3132)b2617
MFCD03273732
ZINC000059222128
ZINC59222128
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