Vitas-M small molecule compound

(7Z)-7-(4-chlorobenzylidene)-3-(3-nitrophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one

Catalog ID
STK724965
SMILES Clc1ccc(cc1)/C=c/1\sc2=NCN(Cn2c1=O)c1cccc(c1)[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 C18H13ClN4O3S MW 400.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClN4O3S/c19-13-6-4-12(5-7-13)8-16-17(24)22-11-21(10-20-18(22)27-16)14-2-1-3-15(9-14)23(25)26/h1-9H,10-11H2/b16-8-
InChIKey
WRISPFTXLBPODX-PXNMLYILSA-N
Synonyms
672329-87-2
(7Z)7((4CHLOROPHENYL)METHYLIDENE)3(3NITROPHENYL)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN6ONE
(7Z)7(4chlorobenzylidene)3(3nitrophenyl)34dihydro2H(13)thiazolo(32a)(135)triazin6(7H)one
(Z)7(4chlorobenzylidene)3(3nitrophenyl)34dihydro2Hthiazolo(32a)(135)triazin6(7H)one
672329872
C1N=C2N(CN1C3=CC(=CC=C3)(N+)(=O)(O))C(=O)C(=CC4=CC=C(C=C4)Cl)S2
Clc1ccc(cc1)C=c1sc2=NCN(Cn2c1=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC18H13ClN4O3Sc19136412(5713)81617(24)221121(102018(22)2716)1421315(914)23(25)26h19H1011H2b168
MFCD04005346
ZINC000001311657
ZINC01311657
ZINC1311657

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Available files

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