Vitas-M small molecule compound

2-cyclopentylidene-N-(3-methylphenyl)hydrazinecarbothioamide

Catalog ID
STK031736
SMILES S=C(Nc1cccc(c1)C)NN=C1CCCC1

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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 C13H17N3S MW 247.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3S/c1-10-5-4-8-12(9-10)14-13(17)16-15-11-6-2-3-7-11/h4-5,8-9H,2-3,6-7H2,1H3,(H2,14,16,17)
InChIKey
HQVXOPIUEDYSHB-UHFFFAOYSA-N
Synonyms
314764-39-1
((CYCLOPENTYLIDENEAZAMETHYL)AMINO)((3METHYLPHENYL)AMINO)METHANE1THIONE
1(CYCLOPENTYLIDENEAMINO)3(3METHYLPHENYL)THIOUREA
2CYCLOPENTYLIDENEN(3METHYLPHENYL)HYDRAZINECARBOTHIOAMIDE
314764391
CC1=CC(=CC=C1)NC(=S)NN=C2CCCC2
CYCLOPENTANONEN(3METHYLPHENYL)THIOSEMICARBAZONE
InChI=1SC13H17N3Sc11054812(910)1413(17)161511623711h4589H2367H21H3(H2141617)
MFCD00567501
S=C(Nc1cccc(c1)C)NN=C1CCCC1
STK031736
ZINC000000046110
ZINC00046110
ZINC46110

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Available files

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