Vitas-M small molecule compound
methyl 2-{[(7-methyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STL021793
SMILES COC(=O)c1c(NC(=O)C2OC(=O)c3c(C2)ccc(c3)C)sc2c1CCC2
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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 C20H19NO5S MW 385.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO5S/c1-10-6-7-11-9-14(26-19(23)13(11)8-10)17(22)21-18-16(20(24)25-2)12-4-3-5-15(12)27-18/h6-8,14H,3-5,9H2,1-2H3,(H,21,22)InChIKey
XCTBNJMDZXZUEX-UHFFFAOYSA-NSynonyms
CC1=CC2=C(CC(OC2=O)C(=O)NC3=C(C4=C(S3)CCC4)C(=O)OC)C=C1
InChI=1SC20H19NO5Sc1106711914(2619(23)13(11)810)17(22)211816(20(24)252)1243515(12)2718h6814H359H212H3(H2122)
methyl2(((7methyl1oxo34dihydro1Hisochromen3yl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2((7METHYL1OXO34DIHYDROISOCHROMENE3CARBONYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
METHYL2((7METHYL1OXOISOCHROMAN3YL)CARBONYLAMINO)456TRIHYDROCYCLOPENTA(21B)THIOPHENE3CARBOXYLATE
MFCD06438615
ZINC000004540070
ZINC000004540071
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