Vitas-M small molecule compound
5-(2,4-dihydroxyphenyl)-4-thioxo-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Catalog ID
STL271580
SMILES O=C1CC(=S)N(c2c(N1)cccc2)c1ccc(cc1O)O
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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 C15H12N2O3S MW 300.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N2O3S/c18-9-5-6-12(13(19)7-9)17-11-4-2-1-3-10(11)16-14(20)8-15(17)21/h1-7,18-19H,8H2,(H,16,20)InChIKey
UVYPJCFFDNWEQI-UHFFFAOYSA-NSynonyms
5(24dihydroxyphenyl)4sulfanylidene1H15benzodiazepin2one
5(24dihydroxyphenyl)4thioxo1345tetrahydro2H15benzodiazepin2one
C1C(=O)NC2=CC=CC=C2N(C1=S)C3=C(C=C(C=C3)O)O
InChI=1SC15H12N2O3Sc1895612(13(19)79)1711421310(11)1614(20)815(17)21h171819H8H2(H1620)
MFCD24853426
ZINC000028526931
ZINC28526931
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