Vitas-M small molecule compound

1-(3-chloro-2-methylphenyl)-3-(3-methylbutyl)thiourea

Catalog ID
STK143206
SMILES CC(CCNC(=S)Nc1cccc(c1C)Cl)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 C13H19ClN2S MW 270.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19ClN2S/c1-9(2)7-8-15-13(17)16-12-6-4-5-11(14)10(12)3/h4-6,9H,7-8H2,1-3H3,(H2,15,16,17)
InChIKey
HRVAOEIHXVWEDU-UHFFFAOYSA-N
Synonyms
433327-36-7
((3CHLORO2METHYLPHENYL)AMINO)((3METHYLBUTYL)AMINO)METHANE1THIONE
1(3CHLORO2METHYLPHENYL)3(3METHYLBUTYL)THIOUREA
433327367
CC1=C(C=CC=C1Cl)NC(=S)NCCC(C)C
InChI=1SC13H19ClN2Sc19(2)781513(17)161264511(14)10(12)3h469H78H213H3(H2151617)
MFCD03170256
N(3CHLORO2METHYLPHENYL)N(3METHYLBUTYL)THIOUREA
ZINC000013482783
ZINC13482783

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Available files

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