1-butyl-3-(3-iodanyl-4-methyl-phenyl)thiourea

Systemtic Name: 1-butyl-3-(3-iodanyl-4-methyl-phenyl)thiourea Openeye Name: 1-butyl-3-(3-iodo-4-methyl-phenyl)thiourea CAS Name: 1-butyl-3-(3-iodo-4-methylphenyl)thiourea IUPAC Name: 1-butyl-3-(3-iodo-4-methylphenyl)thiourea Traditional Name: 1-butyl-3-(3-iodo-4-methyl-phenyl)thiourea Formula: C12H17IN2S MolecularWeight: 348.24625

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CC(=C(C=C1)C)I

Isomeric SMILES

CCCCNC(=S)NC1=CC(=C(C=C1)C)I

InChI

InChI=1S/C12H17IN2S/c1-3-4-7-14-12(16)15-10-6-5-9(2)11(13)8-10/h5-6,8H,3-4,7H2,1-2H3,(H2,14,15,16)