Vitas-M small molecule compound
5-(2-chlorobenzyl)-1-(4-chlorophenyl)-1,3,5-triazinane-2-thione
Catalog ID
STK696118
SMILES Clc1ccc(cc1)N1CN(CNC1=S)Cc1ccccc1Cl
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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 C16H15Cl2N3S MW 352.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15Cl2N3S/c17-13-5-7-14(8-6-13)21-11-20(10-19-16(21)22)9-12-3-1-2-4-15(12)18/h1-8H,9-11H2,(H,19,22)InChIKey
IUFUOWSMMLJXTB-UHFFFAOYSA-NSynonyms
1(4chlorophenyl)5((2chlorophenyl)methyl)135triazinane2thione
5(2chlorobenzyl)1(4chlorophenyl)135triazinane2thione
C1NC(=S)N(CN1CC2=CC=CC=C2Cl)C3=CC=C(C=C3)Cl
InChI=1SC16H15Cl2N3Sc17135714(8613)211120(101916(21)22)912312415(12)18h18H911H2(H1922)
MFCD06757894
ZINC000012375492
ZINC12375492
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