1-(4-butan-2-ylphenyl)-3-[2,4,5-tris(chloranyl)phenyl]thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-[2,4,5-tris(chloranyl)phenyl]thiourea Openeye Name: 1-(4-sec-butylphenyl)-3-(2,4,5-trichlorophenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-(2,4,5-trichlorophenyl)thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-(2,4,5-trichlorophenyl)thiourea Traditional Name: 1-(4-sec-butylphenyl)-3-(2,4,5-trichlorophenyl)thiourea Formula: C17H17Cl3N2S MolecularWeight: 387.75428

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C17H17Cl3N2S/c1-3-10(2)11-4-6-12(7-5-11)21-17(23)22-16-9-14(19)13(18)8-15(16)20/h4-10H,3H2,1-2H3,(H2,21,22,23)