1-[3-(3,4-dimethoxyphenyl)propyl]-3-(2,5-dimethylphenyl)-1-methyl-thiourea

Systemtic Name: 1-[3-(3,4-dimethoxyphenyl)propyl]-3-(2,5-dimethylphenyl)-1-methyl-thiourea Openeye Name: 1-[3-(3,4-dimethoxyphenyl)propyl]-3-(2,5-dimethylphenyl)-1-methyl-thiourea CAS Name: 1-[3-(3,4-dimethoxyphenyl)propyl]-3-(2,5-dimethylphenyl)-1-methylthiourea IUPAC Name: 1-[3-(3,4-dimethoxyphenyl)propyl]-3-(2,5-dimethylphenyl)-1-methylthiourea Traditional Name: 1-[3-(3,4-dimethoxyphenyl)propyl]-3-(2,5-dimethylphenyl)-1-methyl-thiourea Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N(C)CCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N(C)CCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H28N2O2S/c1-15-8-9-16(2)18(13-15)22-21(26)23(3)12-6-7-17-10-11-19(24-4)20(14-17)25-5/h8-11,13-14H,6-7,12H2,1-5H3,(H,22,26)