1-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-[3-(methylthio)propyl]thiourea Formula: C18H26N4S2 MolecularWeight: 362.55584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=S)NCCCSC

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=S)NCCCSC

InChI

InChI=1S/C18H26N4S2/c1-14-17(12-20-18(23)19-10-7-11-24-3)15(2)22(21-14)13-16-8-5-4-6-9-16/h4-6,8-9H,7,10-13H2,1-3H3,(H2,19,20,23)