Vitas-M small molecule compound
3-nitro-N-({3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}carbamothioyl)benzamide
Catalog ID
STK172751
SMILES S=C(NC(=O)c1cccc(c1)[N+](=O)[O-])Nc1cccc(c1)c1nc2c(o1)ccc(c2)C(C)C
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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 C24H20N4O4S MW 460.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4O4S/c1-14(2)15-9-10-21-20(13-15)26-23(32-21)17-6-3-7-18(11-17)25-24(33)27-22(29)16-5-4-8-19(12-16)28(30)31/h3-14H,1-2H3,(H2,25,27,29,33)InChIKey
MEYFEJFFCNDWPO-UHFFFAOYSA-NSynonyms
3NITRON((3(5(PROPAN2YL)13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
3NITRON((3(5PROPAN2YL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
CC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=S)NC(=O)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC24H20N4O4Sc114(2)159102120(1315)2623(3221)1763718(1117)2524(33)2722(29)1654819(1216)28(30)31h314H12H3(H225272933)
MFCD02923058
S=C(NC(=O)c1cccc(c1)(N+)(=O)(O))Nc1cccc(c1)c1nc2c(o1)ccc(c2)C(C)C
ZINC000001181181
ZINC01181181
ZINC1181181
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