Vitas-M small molecule compound

8-oxo-N-(prop-2-en-1-yl)-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide

Catalog ID
STL440284
SMILES C=CCNC(=S)N1CC2CC(C1)c1n(C2)c(=O)ccc1

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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 C15H19N3OS MW 289.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19N3OS/c1-2-6-16-15(20)17-8-11-7-12(10-17)13-4-3-5-14(19)18(13)9-11/h2-5,11-12H,1,6-10H2,(H,16,20)
InChIKey
UUSNTIGQBXXETA-UHFFFAOYSA-N
Synonyms

(1R5R)Nallyl8oxo4568tetrahydro1H15methanopyrido(12a)(15)diazocine3(2H)carbothioamide
8oxoN(prop2en1yl)1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carbothioamide
C=CCNC(=S)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
C=CCNC(=S)N1CC2CC(C1)C3=CC=CC(=O)N3C2
InChI=1SC15H19N3OSc1261615(20)17811712(1017)1343514(19)18(13)911h251112H1610H2(H1620)
MFCD08273177
NALLYLCYTISINE12CARBOTHIOAMIDE
ZINC000002145402

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Available files

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