3-(2,5-dimethylphenyl)-1-phenethyl-1-(2-pyridin-2-ylethyl)thiourea chloride

Systemtic Name: 3-(2,5-dimethylphenyl)-1-phenethyl-1-(2-pyridin-2-ylethyl)thiourea chloride Openeye Name: 3-(2,5-dimethylphenyl)-1-phenethyl-1-[2-(2-pyridyl)ethyl]thiourea chloride CAS Name: 3-(2,5-dimethylphenyl)-1-phenethyl-1-[2-(2-pyridinyl)ethyl]thiourea chloride IUPAC Name: 3-(2,5-dimethylphenyl)-1-phenethyl-1-(2-pyridin-2-ylethyl)thiourea chloride Traditional Name: 3-(2,5-dimethylphenyl)-1-phenethyl-1-[2-(2-pyridyl)ethyl]thiourea chloride Formula: C24H27ClN3S- MolecularWeight: 425.00928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N(CCC2=CC=CC=C2)CCC3=CC=CC=N3.[Cl-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N(CCC2=CC=CC=C2)CCC3=CC=CC=N3.[Cl-]

InChI

InChI=1S/C24H27N3S.ClH/c1-19-11-12-20(2)23(18-19)26-24(28)27(16-13-21-8-4-3-5-9-21)17-14-22-10-6-7-15-25-22;/h3-12,15,18H,13-14,16-17H2,1-2H3,(H,26,28);1H/p-1