Vitas-M small molecule compound
2-{[2-hydroxy-3,5-di(propan-2-yl)phenyl]carbonyl}-N-(3-nitrophenyl)hydrazinecarbothioamide
Catalog ID
STK455267
SMILES S=C(Nc1cccc(c1)[N+](=O)[O-])NNC(=O)c1cc(cc(c1O)C(C)C)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 C20H24N4O4S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O4S/c1-11(2)13-8-16(12(3)4)18(25)17(9-13)19(26)22-23-20(29)21-14-6-5-7-15(10-14)24(27)28/h5-12,25H,1-4H3,(H,22,26)(H2,21,23,29)InChIKey
ONIZTMFIZJABAN-UHFFFAOYSA-NSynonyms
(35BIS(METHYLETHYL)2HYDROXYPHENYL)N((((3NITROPHENYL)AMINO)THIOXOMETHYL)AMINO)CARBOXAMIDE
1((2HYDROXY35DI(PROPAN2YL)BENZOYL)AMINO)3(3NITROPHENYL)THIOUREA
2((2HYDROXY35BIS(1METHYLETHYL)PHENYL)CARBONYL)N(3NITROPHENYL)HYDRAZINECARBOTHIOAMIDE
2((2hydroxy35di(propan2yl)phenyl)carbonyl)N(3nitrophenyl)hydrazinecarbothioamide
CC(C)C1=CC(=C(C(=C1)C(=O)NNC(=S)NC2=CC(=CC=C2)(N+)(=O)(O))O)C(C)C
InChI=1SC20H24N4O4Sc111(2)13816(12(3)4)18(25)17(913)19(26)222320(29)211465715(1014)24(27)28h51225H14H3(H2226)(H2212329)
MFCD04227025
S=C(Nc1cccc(c1)(N+)(=O)(O))NNC(=O)c1cc(cc(c1O)C(C)C)C(C)C
ZINC000001119059
ZINC01119059
ZINC1119059
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