Vitas-M small molecule compound

2-(4-chlorophenyl)-7-methyl-1,2,4-triazaspiro[4.5]decane-3-thione

Catalog ID
STK049653
SMILES CC1CCCC2(C1)NC(=S)N(N2)c1ccc(cc1)Cl

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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 C14H18ClN3S MW 295.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18ClN3S/c1-10-3-2-8-14(9-10)16-13(19)18(17-14)12-6-4-11(15)5-7-12/h4-7,10,17H,2-3,8-9H2,1H3,(H,16,19)
InChIKey
UDTAIPLUPFVHAC-UHFFFAOYSA-N
Synonyms

2(4CHLOROPHENYL)7METHYL124TRIAZASPIRO(45)DECANE3THIONE
3(4CHLOROPHENYL)9METHYL134TRIAZASPIRO(45)DECANE2THIONE
CC1CCCC2(C1)NC(=S)N(N2)c1ccc(cc1)Cl
CC1CCCC2(C1)NC(=S)N(N2)C3=CC=C(C=C3)Cl
InChI=1SC14H18ClN3Sc11032814(910)1613(19)18(1714)126411(15)5712h471017H2389H21H3(H1619)
MFCD02933855
STK049653
ZINC000000089611
ZINC000000089620

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.