1-[(2,4-dimethoxyphenyl)methyl]-1-(4-iodophenyl)-3-phenyl-thiourea

Systemtic Name: 1-[(2,4-dimethoxyphenyl)methyl]-1-(4-iodophenyl)-3-phenyl-thiourea Openeye Name: 1-[(2,4-dimethoxyphenyl)methyl]-1-(4-iodophenyl)-3-phenyl-thiourea CAS Name: 1-[(2,4-dimethoxyphenyl)methyl]-1-(4-iodophenyl)-3-phenylthiourea IUPAC Name: 1-[(2,4-dimethoxyphenyl)methyl]-1-(4-iodophenyl)-3-phenylthiourea Traditional Name: 1-(2,4-dimethoxybenzyl)-1-(4-iodophenyl)-3-phenyl-thiourea Formula: C22H21IN2O2S MolecularWeight: 504.38381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN(C2=CC=C(C=C2)I)C(=S)NC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN(C2=CC=C(C=C2)I)C(=S)NC3=CC=CC=C3)OC

InChI

InChI=1S/C22H21IN2O2S/c1-26-20-13-8-16(21(14-20)27-2)15-25(19-11-9-17(23)10-12-19)22(28)24-18-6-4-3-5-7-18/h3-14H,15H2,1-2H3,(H,24,28)