1-[3,5-bis(chloranyl)phenyl]-3-(4-butylphenyl)thiourea

Systemtic Name: 1-[3,5-bis(chloranyl)phenyl]-3-(4-butylphenyl)thiourea Openeye Name: 1-(4-butylphenyl)-3-(3,5-dichlorophenyl)thiourea CAS Name: 1-(4-butylphenyl)-3-(3,5-dichlorophenyl)thiourea IUPAC Name: 1-(4-butylphenyl)-3-(3,5-dichlorophenyl)thiourea Traditional Name: 1-(4-butylphenyl)-3-(3,5-dichlorophenyl)thiourea Formula: C17H18Cl2N2S MolecularWeight: 353.30922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C17H18Cl2N2S/c1-2-3-4-12-5-7-15(8-6-12)20-17(22)21-16-10-13(18)9-14(19)11-16/h5-11H,2-4H2,1H3,(H2,20,21,22)