Vitas-M small molecule compound
diethyl 2,2'-[(1,6-dioxohexane-1,6-diyl)diimino]bis(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate)
Catalog ID
STK445214
SMILES CCOC(=O)c1c(NC(=O)CCCCC(=O)Nc2sc3c(c2C(=O)OCC)CCCCC3)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 C30H40N2O6S2 MW 588.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H40N2O6S2/c1-3-37-29(35)25-19-13-7-5-9-15-21(19)39-27(25)31-23(33)17-11-12-18-24(34)32-28-26(30(36)38-4-2)20-14-8-6-10-16-22(20)40-28/h3-18H2,1-2H3,(H,31,33)(H,32,34)InChIKey
ROVJDXOTEVRHKO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)CCCCC(=O)NC3=C(C4=C(S3)CCCCC4)C(=O)OCC
diethyl22((16dioxohexane16diyl)diimino)bis(5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate)
ethyl2((6((3ethoxycarbonyl5678tetrahydro4Hcyclohepta(b)thiophen2yl)amino)6oxohexanoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC30H40N2O6S2c133729(35)2519137591521(19)3927(25)3123(33)1711121824(34)322826(30(36)3842)201486101622(20)4028h318H212H3(H3133)(H3234)
MFCD01921745
ZINC000008443902
ZINC08443902
ZINC8443902
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