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

Systemtic Name: 1-(4-iodanyl-3-methyl-phenyl)-3-phenethyl-thiourea Openeye Name: 1-(4-iodo-3-methyl-phenyl)-3-phenethyl-thiourea CAS Name: 1-(4-iodo-3-methylphenyl)-3-phenethylthiourea IUPAC Name: 1-(4-iodo-3-methylphenyl)-3-phenethylthiourea Traditional Name: 1-(4-iodo-3-methyl-phenyl)-3-phenethyl-thiourea Formula: C16H17IN2S MolecularWeight: 396.28905

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)NCCC2=CC=CC=C2)I

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)NCCC2=CC=CC=C2)I

InChI

InChI=1S/C16H17IN2S/c1-12-11-14(7-8-15(12)17)19-16(20)18-10-9-13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H2,18,19,20)