Vitas-M small molecule compound
N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-3-nitro-4-(piperidin-1-yl)benzamide
Catalog ID
STK355550
SMILES N#Cc1c(NC(=S)NC(=O)c2ccc(c(c2)[N+](=O)[O-])N2CCCCC2)sc2c1CCCC2
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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 C22H23N5O3S2 MW 469.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O3S2/c23-13-16-15-6-2-3-7-19(15)32-21(16)25-22(31)24-20(28)14-8-9-17(18(12-14)27(29)30)26-10-4-1-5-11-26/h8-9,12H,1-7,10-11H2,(H2,24,25,28,31)InChIKey
BJVQKIAJHGBJLP-UHFFFAOYSA-NSynonyms
C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC(=S)NC3=C(C4=C(S3)CCCC4)C#N)(N+)(=O)(O)
InChI=1SC22H23N5O3S2c23131615623719(15)3221(16)2522(31)2420(28)148917(18(1214)27(29)30)26104151126h8912H171011H2(H224252831)
MFCD06007300
N#Cc1c(NC(=S)NC(=O)c2ccc(c(c2)(N+)(=O)(O))N2CCCCC2)sc2c1CCCC2
N((3cyano4567tetrahydro1benzothiophen2yl)carbamothioyl)3nitro4(piperidin1yl)benzamide
N((3cyano4567tetrahydro1benzothiophen2yl)carbamothioyl)3nitro4piperidin1ylbenzamide
ZINC000016384464
ZINC16384464
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