3-(2,6-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]thiourea

Systemtic Name: 3-(2,6-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]thiourea Openeye Name: 3-(2,6-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]thiourea CAS Name: 3-(2,6-dimethylphenyl)-1-[3-(1-imidazolyl)propyl]-1-[(2-methoxyphenyl)methyl]thiourea IUPAC Name: 3-(2,6-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]thiourea Traditional Name: 3-(2,6-dimethylphenyl)-1-(3-imidazol-1-ylpropyl)-1-o-anisyl-thiourea Formula: C23H28N4OS MolecularWeight: 408.55962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)N(CCCN2C=CN=C2)CC3=CC=CC=C3OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)N(CCCN2C=CN=C2)CC3=CC=CC=C3OC

InChI

InChI=1S/C23H28N4OS/c1-18-8-6-9-19(2)22(18)25-23(29)27(14-7-13-26-15-12-24-17-26)16-20-10-4-5-11-21(20)28-3/h4-6,8-12,15,17H,7,13-14,16H2,1-3H3,(H,25,29)