3-(4-butylphenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-thiourea

Systemtic Name: 3-(4-butylphenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-thiourea Openeye Name: 3-(4-butylphenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-thiourea CAS Name: 3-(4-butylphenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methylthiourea IUPAC Name: 3-(4-butylphenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methylthiourea Traditional Name: 3-(4-butylphenyl)-1-homoveratryl-1-methyl-thiourea Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N(C)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N(C)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H30N2O2S/c1-5-6-7-17-8-11-19(12-9-17)23-22(27)24(2)15-14-18-10-13-20(25-3)21(16-18)26-4/h8-13,16H,5-7,14-15H2,1-4H3,(H,23,27)