Vitas-M small molecule compound

(3bS,4aR)-N-ethyl-3,4,4-trimethyl-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole-1-carbothioamide

Catalog ID
STL526886
SMILES CCNC(=S)n1nc(c2c1C[C@@H]1[C@H]2C1(C)C)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 C13H19N3S MW 249.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19N3S/c1-5-14-12(17)16-9-6-8-11(13(8,3)4)10(9)7(2)15-16/h8,11H,5-6H2,1-4H3,(H,14,17)/t8-,11-/m1/s1
InChIKey
FWWZFUCBOADTRX-LDYMZIIASA-N
Synonyms
1212336-39-4
(2~(S)4~(R))~(N)ethyl339trimethyl78diazatricyclo(4300^(24))nona1(6)8diene7carbothioamide
(3bS4aR)Nethyl344trimethyl3b44a5tetrahydro1Hcyclopropa(34)cyclopenta(12c)pyrazole1carbothioamide
1212336394
1755593
CCNC(=S)n1nc(c2c1C(C@@H)1(C@H)2C1(C)C)C
InChI=1SC13H19N3Sc151412(17)1696811(13(83)4)10(9)7(2)1516h811H56H214H3(H1417)t811m1s1
MFCD03266012
ZINC000002099567
ZINC2099567

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Available files

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