Vitas-M small molecule compound
6-tert-butyl-2-{[(E)-(5-nitrothiophen-2-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Catalog ID
STK752025
SMILES N#Cc1c(/N=C/c2ccc(s2)[N+](=O)[O-])sc2c1CCC(C2)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 C18H19N3O2S2 MW 373.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O2S2/c1-18(2,3)11-4-6-13-14(9-19)17(25-15(13)8-11)20-10-12-5-7-16(24-12)21(22)23/h5,7,10-11H,4,6,8H2,1-3H3/b20-10+InChIKey
LKOVWLRSDHSYQD-KEBDBYFISA-NSynonyms
6tertbutyl2(((E)(5nitrothiophen2yl)methylidene)amino)4567tetrahydro1benzothiophene3carbonitrile
6tertbutyl2((E)(5nitrothiophen2yl)methylideneamino)4567tetrahydro1benzothiophene3carbonitrile
CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)N=CC3=CC=C(S3)(N+)(=O)(O)
InChI=1SC18H19N3O2S2c118(23)11461314(919)17(2515(13)811)2010125716(2412)21(22)23h571011H468H213H3b2010+
MFCD00748063
N#Cc1c(N=Cc2ccc(s2)(N+)(=O)(O))sc2c1CCC(C2)C(C)(C)C
ZINC000001445212
ZINC000001445214
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