Vitas-M small molecule compound
3-chloro-N-{3-methoxy-4-[(2-methylpropanoyl)amino]phenyl}-7-nitro-1-benzothiophene-2-carboxamide
Catalog ID
STK220375
SMILES COc1cc(ccc1NC(=O)C(C)C)NC(=O)c1sc2c(c1Cl)cccc2[N+](=O)[O-]
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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 C20H18ClN3O5S MW 447.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN3O5S/c1-10(2)19(25)23-13-8-7-11(9-15(13)29-3)22-20(26)18-16(21)12-5-4-6-14(24(27)28)17(12)30-18/h4-10H,1-3H3,(H,22,26)(H,23,25)InChIKey
SASXXJVSZZSHDV-UHFFFAOYSA-NSynonyms
879020-21-03chloroN(3methoxy4((2methylpropanoyl)amino)phenyl)7nitro1benzothiophene2carboxamide
3chloroN(3methoxy4(2methylpropanoylamino)phenyl)7nitro1benzothiophene2carboxamide
3chloroN(4isobutyramido3methoxyphenyl)7nitrobenzo(b)thiophene2carboxamide
879020210
CC(C)C(=O)NC1=C(C=C(C=C1)NC(=O)C2=C(C3=C(S2)C(=CC=C3)(N+)(=O)(O))Cl)OC
COc1cc(ccc1NC(=O)C(C)C)NC(=O)c1sc2c(c1Cl)cccc2(N+)(=O)(O)
InChI=1SC20H18ClN3O5Sc110(2)19(25)23138711(915(13)293)2220(26)1816(21)1254614(24(27)28)17(12)3018h410H13H3(H2226)(H2325)
MFCD07087173
ZINC000008770614
ZINC08770614
ZINC8770614
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