Vitas-M small molecule compound
3-methyl-4-[(9H-xanthen-9-ylacetyl)amino]phenyl thiocyanate
Catalog ID
STK136584
SMILES N#CSc1ccc(c(c1)C)NC(=O)CC1c2ccccc2Oc2c1cccc2
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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 C23H18N2O2S MW 386.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O2S/c1-15-12-16(28-14-24)10-11-20(15)25-23(26)13-19-17-6-2-4-8-21(17)27-22-9-5-3-7-18(19)22/h2-12,19H,13H2,1H3,(H,25,26)InChIKey
USDCTCZFQHASCK-UHFFFAOYSA-NSynonyms
(3METHYL4((2(9HXANTHEN9YL)ACETYL)AMINO)PHENYL)THIOCYANATE
3METHYL4((9HXANTHEN9YLACETYL)AMINO)PHENYLTHIOCYANATE
CC1=C(C=CC(=C1)SC#N)NC(=O)CC2C3=CC=CC=C3OC4=CC=CC=C24
InChI=1SC23H18N2O2Sc1151216(281424)101120(15)2523(26)131917624821(17)2722953718(19)22h21219H13H21H3(H2526)
MFCD02625798
N(4CYANOTHIO2METHYLPHENYL)2XANTHEN9YLACETAMIDE
ZINC000000716957
ZINC00716957
ZINC716957
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