Vitas-M small molecule compound
N-[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]-4-methoxy-3-nitrobenzamide
Catalog ID
STK236995
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)Nc1ccc(c(c1)Cl)c1nc2c(s1)cccc2
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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 C21H14ClN3O4S MW 439.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClN3O4S/c1-29-18-9-6-12(10-17(18)25(27)28)20(26)23-13-7-8-14(15(22)11-13)21-24-16-4-2-3-5-19(16)30-21/h2-11H,1H3,(H,23,26)InChIKey
GOEYDSAWFPNMJZ-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)C3=NC4=CC=CC=C4S3)Cl)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)Nc1ccc(c(c1)Cl)c1nc2c(s1)cccc2
InChI=1SC21H14ClN3O4Sc129189612(1017(18)25(27)28)20(26)23137814(15(22)1113)212416423519(16)3021h211H1H3(H2326)
MFCD04360899
N(4(13benzothiazol2yl)3chlorophenyl)4methoxy3nitrobenzamide
ZINC000002853983
ZINC02853983
ZINC2853983
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