Vitas-M small molecule compound
N-(3-bromophenyl)-2-[(3,6-dimethyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STL084319
SMILES O=C(Nc1cccc(c1)Br)CSc1nc2cc([nH]c2c(=O)n1C)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 C16H15BrN4O2S MW 407.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrN4O2S/c1-9-6-12-14(18-9)15(23)21(2)16(20-12)24-8-13(22)19-11-5-3-4-10(17)7-11/h3-7,18H,8H2,1-2H3,(H,19,22)InChIKey
CLLPYRCPCLVSKI-UHFFFAOYSA-NSynonyms
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NC3=CC(=CC=C3)Br)C
InChI=1SC16H15BrN4O2Sc1961214(189)15(23)21(2)16(2012)24813(22)191153410(17)711h3718H8H212H3(H1922)
MFCD18202889
N(3bromophenyl)2((36dimethyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(3bromophenyl)2((36dimethyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
O=C(Nc1cccc(c1)Br)CSc1nc2cc((nH)c2c(=O)n1C)C
ZINC000057521492
ZINC57521492
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