Vitas-M small molecule compound

N-[(E)-amino{[(2E)-4-oxo-3,4-dihydro-2H-1,3-benzothiazin-2-ylidene]amino}methylidene]-3-bromobenzamide

Catalog ID
STK789939
SMILES Brc1cccc(c1)C(=O)/N=C(/N=c\1/sc2ccccc2c(=O)[nH]1)\N

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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 C16H11BrN4O2S MW 403.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11BrN4O2S/c17-10-5-3-4-9(8-10)13(22)19-15(18)21-16-20-14(23)11-6-1-2-7-12(11)24-16/h1-8H,(H3,18,19,20,21,22,23)
InChIKey
MQCDXZLRAWUCEY-UHFFFAOYSA-N
Synonyms

(E)N(amino((E)(4oxo34dihydro2Hbenzo(e)(13)thiazin2ylidene)amino)methylene)3bromobenzamide
3BROMON((4OXO4H13BENZOTHIAZIN2YL)CARBAMIMIDOYL)BENZAMIDE
3BROMON(N(4OXO13BENZOTHIAZIN2YL)CARBAMIMIDOYL)BENZAMIDE
Brc1cccc(c1)C(=O)N=C(N=c1sc2ccccc2c(=O)(nH)1)N
C1=CC=C2C(=C1)C(=O)N=C(S2)N=C(N)NC(=O)C3=CC(=CC=C3)Br
InChI=1SC16H11BrN4O2Sc17105349(810)13(22)1915(18)21162014(23)11612712(11)2416h18H(H3181920212223)
MFCD02164355
N((E)amino(((2E)4oxo34dihydro2H13benzothiazin2ylidene)amino)methylidene)3bromobenzamide
ZINC000004816031
ZINC4816031

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Available files

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