Vitas-M small molecule compound
N-(7-methyl-4-oxo-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK438765
SMILES CC1CCc2c(C1)sc1c2c(=O)n(c(n1)S)NC(=O)c1csc2c1CCCC2
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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 C20H21N3O2S3 MW 431.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O2S3/c1-10-6-7-12-15(8-10)28-18-16(12)19(25)23(20(26)21-18)22-17(24)13-9-27-14-5-3-2-4-11(13)14/h9-10H,2-8H2,1H3,(H,21,26)(H,22,24)InChIKey
MXCGRUDGJGSMDU-UHFFFAOYSA-NSynonyms
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=S)N3)NC(=O)C4=CSC5=C4CCCC5
InChI=1SC20H21N3O2S3c110671215(810)281816(12)19(25)23(20(26)2118)2217(24)1392714532411(13)14h910H28H21H3(H2126)(H2224)
MFCD03945388
N(7methyl4oxo2sulfanyl5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)4567tetrahydro1benzothiophene3carboxamide
N(7methyl4oxo2sulfanylidene5678tetrahydro1H(1)benzothiolo(23d)pyrimidin3yl)4567tetrahydro1benzothiophene3carboxamide
ZINC000017097677
ZINC000017097678
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