Vitas-M small molecule compound

2-methoxy-3-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide

Catalog ID
STK892226
SMILES COc1c(C)cccc1C(=O)Nc1nc2c(s1)cc(cc2)[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 C16H13N3O4S MW 343.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O4S/c1-9-4-3-5-11(14(9)23-2)15(20)18-16-17-12-7-6-10(19(21)22)8-13(12)24-16/h3-8H,1-2H3,(H,17,18,20)
InChIKey
VOUBIEDLSYVNIQ-UHFFFAOYSA-N
Synonyms

2methoxy3methylN(6nitro13benzothiazol2yl)benzamide
CC1=CC=CC(=C1OC)C(=O)NC2=NC3=C(S2)C=C(C=C3)(N+)(=O)(O)
COc1c(C)cccc1C(=O)Nc1nc2c(s1)cc(cc2)(N+)(=O)(O)
InChI=1SC16H13N3O4Sc1943511(14(9)232)15(20)181617127610(19(21)22)813(12)2416h38H12H3(H171820)
MFCD06633540
ZINC000004839640
ZINC04839640
ZINC4839640

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Available files

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