Vitas-M small molecule compound
4-{2-[(Z)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-1H-pyrrol-1-yl}benzoic acid
Catalog ID
STK165285
SMILES OC(=O)c1ccc(cc1)n1cccc1/C=c/1\sc2n(c1=O)c1c(n2)cccc1
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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 C21H13N3O3S MW 387.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13N3O3S/c25-19-18(28-21-22-16-5-1-2-6-17(16)24(19)21)12-15-4-3-11-23(15)14-9-7-13(8-10-14)20(26)27/h1-12H,(H,26,27)/b18-12-InChIKey
POLYHMGFJSSGDP-PDGQHHTCSA-NSynonyms
445407-03-4(Z)4(2((3oxobenzo(45)imidazo(21b)thiazol2(3H)ylidene)methyl)1Hpyrrol1yl)benzoicacid
4(2((Z)(1OXO(13)THIAZOLO(32A)BENZIMIDAZOL2YLIDENE)METHYL)PYRROL1YL)BENZOICACID
4(2((Z)(3OXO(13)THIAZOLO(32A)BENZIMIDAZOL2(3H)YLIDENE)METHYL)1HPYRROL1YL)BENZOICACID
445407034
C1=CC=C2C(=C1)N=C3N2C(=O)C(=CC4=CC=CN4C5=CC=C(C=C5)C(=O)O)S3
InChI=1SC21H13N3O3Sc251918(28212216512617(16)24(19)21)1215431123(15)149713(81014)20(26)27h112H(H2627)b1812
MFCD03270594
OC(=O)c1ccc(cc1)n1cccc1C=c1sc2n(c1=O)c1c(n2)cccc1
ZINC000001896626
ZINC1896626
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