Vitas-M small molecule compound
N-(4-ethoxyphenyl)-2-[8-methoxy-3-(3-methylbutyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydro-5H-pyrimido[5,4-b]indol-5-yl]acetamide
Catalog ID
STL145297
SMILES CCOc1ccc(cc1)NC(=O)Cn1c2ccc(cc2c2c1c(=O)n(c(=S)[nH]2)CCC(C)C)OC
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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 C26H30N4O4S MW 494.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O4S/c1-5-34-18-8-6-17(7-9-18)27-22(31)15-30-21-11-10-19(33-4)14-20(21)23-24(30)25(32)29(26(35)28-23)13-12-16(2)3/h6-11,14,16H,5,12-13,15H2,1-4H3,(H,27,31)(H,28,35)InChIKey
QTUMHMQFMFMSKQ-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)NC(=O)CN2C3=C(C=C(C=C3)OC)C4=C2C(=O)N(C(=S)N4)CCC(C)C
CCOc1ccc(cc1)NC(=O)Cn1c2ccc(cc2c2c1c(=O)n(c(=S)(nH)2)CCC(C)C)OC
InChI=1SC26H30N4O4Sc1534188617(7918)2722(31)153021111019(334)1420(21)2324(30)25(32)29(26(35)2823)131216(2)3h6111416H5121315H214H3(H2731)(H2835)
MFCD20754893
N(4ethoxyphenyl)2(8methoxy3(3methylbutyl)4oxo2sulfanylidene1Hpyrimido(54b)indol5yl)acetamide
N(4ethoxyphenyl)2(8methoxy3(3methylbutyl)4oxo2thioxo1234tetrahydro5Hpyrimido(54b)indol5yl)acetamide
ZINC000071328590
ZINC71328590
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