Vitas-M small molecule compound
2-[(2E)-2-{2-[3-(3-methylphenoxy)propoxy]-5-nitrobenzylidene}hydrazinyl]-1,3-benzothiazole
Catalog ID
STK109943
SMILES Cc1cccc(c1)OCCCOc1ccc(cc1/C=N/Nc1nc2c(s1)cccc2)[N+](=O)[O-]
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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 C24H22N4O4S MW 462.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O4S/c1-17-6-4-7-20(14-17)31-12-5-13-32-22-11-10-19(28(29)30)15-18(22)16-25-27-24-26-21-8-2-3-9-23(21)33-24/h2-4,6-11,14-16H,5,12-13H2,1H3,(H,26,27)/b25-16+InChIKey
SRJXQSAVCQQZCX-PCLIKHOPSA-NSynonyms
2((2E)2(2(3(3METHYLPHENOXY)PROPOXY)5NITROBENZYLIDENE)HYDRAZINYL)13BENZOTHIAZOLE
CC1=CC(=CC=C1)OCCCOC2=C(C=C(C=C2)(N+)(=O)(O))C=NNC3=NC4=CC=CC=C4S3
Cc1cccc(c1)OCCCOc1ccc(cc1C=NNc1nc2c(s1)cccc2)(N+)(=O)(O)
InChI=1SC24H22N4O4Sc11764720(1417)31125133222111019(28(29)30)1518(22)162527242621823923(21)3324h246111416H51213H21H3(H2627)b2516+
MFCD08672956
N((E)(2(3(3methylphenoxy)propoxy)5nitrophenyl)methylideneamino)13benzothiazol2amine
ZINC000009763173
ZINC96624443
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