Vitas-M small molecule compound
5-{[3-carbamoyl-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-5-oxopentanoic acid
Catalog ID
STK441532
SMILES CCC(C1CCc2c(C1)sc(c2C(=O)N)NC(=O)CCCC(=O)O)(C)C
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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 C19H28N2O4S MW 380.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H28N2O4S/c1-4-19(2,3)11-8-9-12-13(10-11)26-18(16(12)17(20)25)21-14(22)6-5-7-15(23)24/h11H,4-10H2,1-3H3,(H2,20,25)(H,21,22)(H,23,24)InChIKey
DRIAAKRDZOIYFB-UHFFFAOYSA-NSynonyms
5((3carbamoyl6(2methylbutan2yl)4567tetrahydro1benzothiophen2yl)amino)5oxopentanoicacid
CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CCCC(=O)O
InChI=1SC19H28N2O4Sc1419(23)11891213(1011)2618(16(12)17(20)25)2114(22)65715(23)24h11H410H213H3(H22025)(H2122)(H2324)
MFCD01359342
ZINC000004646611
ZINC000004646612
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