Vitas-M small molecule compound
2-({(1Z)-1-[1-(1,3-benzothiazol-2-yl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]ethyl}amino)benzonitrile
Catalog ID
STK207127
SMILES N#Cc1ccccc1N/C(=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)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 C20H15N5OS MW 373.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N5OS/c1-12(22-15-8-4-3-7-14(15)11-21)18-13(2)24-25(19(18)26)20-23-16-9-5-6-10-17(16)27-20/h3-10,22H,1-2H3/b18-12-InChIKey
KWWRPILPOOVLIJ-PDGQHHTCSA-NSynonyms
2(((1BENZOTHIAZOL2YL3METHYL5OXO12DIAZOLIN4YLIDENE)ETHYL)AMINO)BENZENECARBONITRILE
2(((1Z)1(1(13benzothiazol2yl)3methyl5oxo15dihydro4Hpyrazol4ylidene)ethyl)amino)benzonitrile
2(((1Z)1(1(13BENZOTHIAZOL2YL)3METHYL5OXOPYRAZOL4YLIDENE)ETHYL)AMINO)BENZONITRILE
CC1=NN(C(=O)C1=C(C)NC2=CC=CC=C2C#N)C3=NC4=CC=CC=C4S3
InChI=1SC20H15N5OSc112(2215843714(15)1121)1813(2)2425(19(18)26)2023169561017(16)2720h31022H12H3b1812
MFCD06191762
N#Cc1ccccc1NC(=C1C(=NN(C1=O)c1nc2c(s1)cccc2)C)C
ZINC000100430492
ZINC100430492
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