N-(2,4-dimethylphenyl)-4-(5-propylpyrimidin-2-yl)-1,4-diazepane-1-carbothioamide

Molecular Formula: C21H29N5S


InChI: InChI=1/C21H29N5S/c1-4-6-18-14-22-20(23-15-18)25-9-5-10-26(12-11-25)21(27)24-19-8-7-16(2)13-17(19)3/h7-8,13-15H,4-6,9-12H2,1-3H3,(H,24,27)/f/h24H

InChIKey: InChIKey=XXRNSVRKETVVDJ-LQFNOIFHCN
SMILES: CCCC1=CN=C(N=C1)N2CCCN(CC2)C(=S)NC3=C(C=C(C=C3)C)C

Names:
    N-(2,4-dimethylphenyl)-4-(5-propylpyrimidin-2-yl)-1,4-diazepane-1-carbothioamide

Registries:
    PubChem CID 2796033
    PubChem ID 3251725