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3-[(7Z)-6-oxo-7-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl]benzoic acid

Catalog ID
STK685780
SMILES O=C1Nc2c(/C/1=c\1/sc3=NCN(Cn3c1=O)c1cccc(c1)C(=O)O)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 C20H14N4O4S MW 406.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N4O4S/c25-17-15(13-6-1-2-7-14(13)22-17)16-18(26)24-10-23(9-21-20(24)29-16)12-5-3-4-11(8-12)19(27)28/h1-8H,9-10H2,(H,22,25)(H,27,28)/b16-15-
InChIKey
FUGHSZCNMYKYEB-NXVVXOECSA-N
Synonyms
3((7Z)6oxo7(2oxo12dihydro3Hindol3ylidene)67dihydro2H(13)thiazolo(32a)(135)triazin3(4H)yl)benzoicacid
3((7Z)6OXO7(2OXO1HINDOL3YLIDENE)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN3YL)BENZOICACID
C1N=C2N(CN1C3=CC=CC(=C3)C(=O)O)C(=O)C(=C4C5=CC=CC=C5NC4=O)S2
O=C1Nc2c(C1=c1sc3=NCN(Cn3c1=O)c1cccc(c1)C(=O)O)cccc2
Registry IDs
MFCD06013336
ZINC000004622583
ZINC4622583

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Available files

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