Vitas-M small molecule compound
5-(3-nitrophenyl)-N-[(2-oxo-2H-chromen-6-yl)carbamothioyl]furan-2-carboxamide
Catalog ID
STL062080
SMILES S=C(NC(=O)c1ccc(o1)c1cccc(c1)[N+](=O)[O-])Nc1ccc2c(c1)ccc(=O)o2
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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 C21H13N3O6S MW 435.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13N3O6S/c25-19-9-4-13-10-14(5-6-17(13)30-19)22-21(31)23-20(26)18-8-7-16(29-18)12-2-1-3-15(11-12)24(27)28/h1-11H,(H2,22,23,26,31)InChIKey
YMIXABFTXPAWDV-UHFFFAOYSA-NSynonyms
716330-74-45(3nitrophenyl)N((2oxo2Hchromen6yl)carbamothioyl)furan2carboxamide
5(3NITROPHENYL)N((2OXOCHROMEN6YL)CARBAMOTHIOYL)FURAN2CARBOXAMIDE
716330744
C1=CC(=CC(=C1)(N+)(=O)(O))C2=CC=C(O2)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=O)C=C4
InChI=1SC21H13N3O6Sc251994131014(5617(13)3019)2221(31)2320(26)188716(2918)1221315(1112)24(27)28h111H(H222232631)
MFCD04179215
S=C(NC(=O)c1ccc(o1)c1cccc(c1)(N+)(=O)(O))Nc1ccc2c(c1)ccc(=O)o2
ZINC000002198502
ZINC02198502
ZINC2198502
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