Vitas-M small molecule compound
methyl 2-({[(2-phenylquinolin-4-yl)carbonyl]carbamothioyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK301323
SMILES COC(=O)c1c(NC(=S)NC(=O)c2cc(nc3c2cccc3)c2ccccc2)sc2c1CCCCC2
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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 C28H25N3O3S2 MW 515.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O3S2/c1-34-27(33)24-19-13-6-3-7-15-23(19)36-26(24)31-28(35)30-25(32)20-16-22(17-10-4-2-5-11-17)29-21-14-9-8-12-18(20)21/h2,4-5,8-12,14,16H,3,6-7,13,15H2,1H3,(H2,30,31,32,35)InChIKey
IVNAMNHQOPKVOE-UHFFFAOYSA-NSynonyms
438612-98-7438612987
COC(=O)C1=C(SC2=C1CCCCC2)NC(=S)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5
InChI=1SC28H25N3O3S2c13427(33)2419136371523(19)3626(24)3128(35)3025(32)201622(17104251117)292114981218(20)21h2458121416H3671315H21H3(H230313235)
methyl2((((2phenylquinolin4yl)carbonyl)carbamothioyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2((2phenylquinoline4carbonyl)carbamothioylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD02604562
ZINC000002726764
ZINC02726764
ZINC2726764
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