Vitas-M small molecule compound
4-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3-ium-4-ylamino)butanoate
Catalog ID
STK564258
SMILES [O-]C(=O)CCCNc1[nH+]cnc2c1c1CCCCc1s2
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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 C14H17N3O2S MW 291.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N3O2S/c18-11(19)6-3-7-15-13-12-9-4-1-2-5-10(9)20-14(12)17-8-16-13/h8H,1-7H2,(H,18,19)(H,15,16,17)InChIKey
SVEXEHYBLPXJCM-UHFFFAOYSA-NSynonyms
313534-23-5(O)C(=O)CCCNc1(nH+)cnc2c1c1CCCCc1s2
4(5678tetrahydro(1)benzothieno(23d)pyrimidin3ium4ylamino)butanoate
4(5678tetrahydro(1)benzothiolo(23d)pyrimidin1ium4ylamino)butanoate
C1CCC2=C(C1)C3=C(N=C(NH+)=C3S2)NCCCC(=O)(O)
InChI=1SC14H17N3O2Sc1811(19)6371513129412510(9)2014(12)1781613h8H17H2(H1819)(H151617)
MFCD00422786
ZINC000006224107
ZINC6224107
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