Vitas-M small molecule compound
methyl 2-{[(2-amino-1-pentyl-1H-pyrrolo[2,3-b]quinoxalin-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK540041
SMILES CCCCCn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2
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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 C26H29N5O3S MW 491.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N5O3S/c1-3-4-9-14-31-22(27)20(21-23(31)29-17-12-7-6-11-16(17)28-21)24(32)30-25-19(26(33)34-2)15-10-5-8-13-18(15)35-25/h6-7,11-12H,3-5,8-10,13-14,27H2,1-2H3,(H,30,32)InChIKey
OCRCTDFICYWJJK-UHFFFAOYSA-NSynonyms
371117-61-2371117612
CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)OC)N
InChI=1SC26H29N5O3Sc1349143122(27)20(2123(31)291712761116(17)2821)24(32)302519(26(33)342)1510581318(15)3525h671112H35810131427H212H3(H3032)
methyl2(((2amino1pentyl1Hpyrrolo(23b)quinoxalin3yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2amino1pentylpyrrolo(32b)quinoxaline3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2(2amino1pentyl1Hpyrrolo(23b)quinoxaline3carboxamido)4567tetrahydrobenzo(b)thiophene3carboxylate
MFCD03007609
ZINC000002313757
ZINC02313757
ZINC2313757
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