Vitas-M small molecule compound
2-[(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(1,3-thiazol-2-yl)propanamide
Catalog ID
STK221631
SMILES O=C(C(Sc1nc2sc3c(c2c(=O)[nH]1)CCCC3)C)Nc1nccs1
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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 C16H16N4O2S3 MW 392.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O2S3/c1-8(12(21)18-15-17-6-7-23-15)24-16-19-13(22)11-9-4-2-3-5-10(9)25-14(11)20-16/h6-8H,2-5H2,1H3,(H,17,18,21)(H,19,20,22)InChIKey
NCHJBHBNUALVSP-UHFFFAOYSA-NSynonyms
2((4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(13thiazol2yl)propanamide
2((4oxo5678tetrahydro3H(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(13thiazol2yl)propanamide
CC(C(=O)NC1=NC=CS1)SC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2
InChI=1SC16H16N4O2S3c18(12(21)181517672315)24161913(22)119423510(9)2514(11)2016h68H25H21H3(H171821)(H192022)
MFCD07399045
O=C(C(Sc1nc2sc3c(c2c(=O)(nH)1)CCCC3)C)Nc1nccs1
ZINC000004741920
ZINC000004741921
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