Vitas-M small molecule compound
methyl (2Z)-5-amino-6-(1,3-benzothiazol-2-yl)-2-benzylidene-3-oxo-7-phenyl-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-8-carboxylate
Catalog ID
STL361878
SMILES COC(=O)C1=c2s/c(=C\c3ccccc3)/c(=O)n2C(=C(C1c1ccccc1)c1nc2c(s1)cccc2)N
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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 C29H21N3O3S2 MW 523.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21N3O3S2/c1-35-29(34)24-22(18-12-6-3-7-13-18)23(26-31-19-14-8-9-15-20(19)36-26)25(30)32-27(33)21(37-28(24)32)16-17-10-4-2-5-11-17/h2-16,22H,30H2,1H3/b21-16-InChIKey
LBMMBLHHCXPUHB-PGMHBOJBSA-NSynonyms
(E)methyl5amino6(benzo(d)thiazol2yl)2benzylidene3oxo7phenyl37dihydro2Hthiazolo(32a)pyridine8carboxylate
COC(=O)C1=C2N(C(=C(C1C3=CC=CC=C3)C4=NC5=CC=CC=C5S4)N)C(=O)C(=CC6=CC=CC=C6)S2
COC(=O)C1=c2sc(=Cc3ccccc3)c(=O)n2C(=C(C1c1ccccc1)c1nc2c(s1)cccc2)N
InChI=1SC29H21N3O3S2c13529(34)2422(18126371318)23(26311914891520(19)3626)25(30)3227(33)21(3728(24)32)1617104251117h21622H30H21H3b2116
methyl(2Z)5amino6(13benzothiazol2yl)2benzylidene3oxo7phenyl23dihydro7H(13)thiazolo(32a)pyridine8carboxylate
METHYL(2Z)5AMINO6(13BENZOTHIAZOL2YL)2BENZYLIDENE3OXO7PHENYL7H(13)THIAZOLO(32A)PYRIDINE8CARBOXYLATE
METHYL5AMINO6(13BENZOTHIAZOL2YL)2BENZYLIDENE3OXO7PHENYL23DIHYDRO7H(13)THIAZOLO(32A)PYRIDINE8CARBOXYLATE
MFCD01647476
ZINC000008448516
ZINC000008448517
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