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

Systemtic Name: 3-(4-butylphenyl)-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 3-(4-butylphenyl)-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 3-(4-butylphenyl)-1-[(2,4-dimethoxyphenyl)methyl]-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 3-(4-butylphenyl)-1-[(2,4-dimethoxyphenyl)methyl]-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 3-(4-butylphenyl)-1-(2,4-dimethoxybenzyl)-1-(3-imidazol-1-ylpropyl)thiourea Formula: C26H34N4O2S MolecularWeight: 466.63876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N(CCCN2C=CN=C2)CC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N(CCCN2C=CN=C2)CC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C26H34N4O2S/c1-4-5-7-21-8-11-23(12-9-21)28-26(33)30(16-6-15-29-17-14-27-20-29)19-22-10-13-24(31-2)18-25(22)32-3/h8-14,17-18,20H,4-7,15-16,19H2,1-3H3,(H,28,33)