Vitas-M small molecule compound
ethyl 2-(2,5-dimethyl-3-{(E)-[1-methyl-5-(morpholin-4-ylsulfonyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]methyl}-1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL448684
SMILES CCOC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)/C=C/1\c2cc(ccc2N(C1=O)C)S(=O)(=O)N1CCOCC1
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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 C31H35N3O6S2 MW 609.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35N3O6S2/c1-5-40-31(36)28-23-8-6-7-9-27(23)41-30(28)34-19(2)16-21(20(34)3)17-25-24-18-22(10-11-26(24)32(4)29(25)35)42(37,38)33-12-14-39-15-13-33/h10-11,16-18H,5-9,12-15H2,1-4H3/b25-17+InChIKey
FDFYIZRUORPWKH-KOEQRZSOSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)N3C(=CC(=C3C)C=C4C5=C(C=CC(=C5)S(=O)(=O)N6CCOCC6)N(C4=O)C)C
CCOC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)C=C1c2cc(ccc2N(C1=O)C)S(=O)(=O)N1CCOCC1
ethyl2(25dimethyl3((E)(1methyl5(morpholin4ylsulfonyl)2oxo12dihydro3Hindol3ylidene)methyl)1Hpyrrol1yl)4567tetrahydro1benzothiophene3carboxylate
ethyl2(25dimethyl3((E)(1methyl5morpholin4ylsulfonyl2oxoindol3ylidene)methyl)pyrrol1yl)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC31H35N3O6S2c154031(36)2823867927(23)4130(28)3419(2)1621(20(34)3)1725241822(101126(24)32(4)29(25)35)42(3738)33121439151333h10111618H591215H214H3b2517+
MFCD30712982
ZINC000101377574
ZINC101377574
Check stock
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Check stock on Vitas-MAvailable files
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