1-(4-butyl-2-methyl-phenyl)-3-[(3-iodanylphenyl)methyl]thiourea

Systemtic Name: 1-(4-butyl-2-methyl-phenyl)-3-[(3-iodanylphenyl)methyl]thiourea Openeye Name: 1-(4-butyl-2-methyl-phenyl)-3-[(3-iodophenyl)methyl]thiourea CAS Name: 1-(4-butyl-2-methylphenyl)-3-[(3-iodophenyl)methyl]thiourea IUPAC Name: 1-(4-butyl-2-methylphenyl)-3-[(3-iodophenyl)methyl]thiourea Traditional Name: 1-(4-butyl-2-methyl-phenyl)-3-(3-iodobenzyl)thiourea Formula: C19H23IN2S MolecularWeight: 438.36879

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=S)NCC2=CC(=CC=C2)I)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=S)NCC2=CC(=CC=C2)I)C

InChI

InChI=1S/C19H23IN2S/c1-3-4-6-15-9-10-18(14(2)11-15)22-19(23)21-13-16-7-5-8-17(20)12-16/h5,7-12H,3-4,6,13H2,1-2H3,(H2,21,22,23)