Vitas-M small molecule compound
3-(4-oxo-7-phenyl-2-sulfanyl-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-3-yl)propanoic acid
Catalog ID
STL083802
SMILES OC(=O)CCn1c(S)nc2c(c1=O)[nH]cc2c1ccccc1
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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 C15H13N3O3S MW 315.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O3S/c19-11(20)6-7-18-14(21)13-12(17-15(18)22)10(8-16-13)9-4-2-1-3-5-9/h1-5,8,16H,6-7H2,(H,17,22)(H,19,20)InChIKey
QAPJJEUQYDOGPL-UHFFFAOYSA-NSynonyms
3(4oxo7phenyl2sulfanyl45dihydro3Hpyrrolo(32d)pyrimidin3yl)propanoicacid
3(4oxo7phenyl2sulfanylidene15dihydropyrrolo(32d)pyrimidin3yl)propanoicacid
C1=CC=C(C=C1)C2=CNC3=C2NC(=S)N(C3=O)CCC(=O)O
InChI=1SC15H13N3O3Sc1911(20)671814(21)1312(1715(18)22)10(81613)9421359h15816H67H2(H1722)(H1920)
MFCD18202480
OC(=O)CCn1c(S)nc2c(c1=O)(nH)cc2c1ccccc1
ZINC000100071633
ZINC100071633
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