1-[2,5-bis(chloranyl)phenyl]-3-(2-butylphenyl)thiourea

Systemtic Name: 1-[2,5-bis(chloranyl)phenyl]-3-(2-butylphenyl)thiourea Openeye Name: 1-(2-butylphenyl)-3-(2,5-dichlorophenyl)thiourea CAS Name: 1-(2-butylphenyl)-3-(2,5-dichlorophenyl)thiourea IUPAC Name: 1-(2-butylphenyl)-3-(2,5-dichlorophenyl)thiourea Traditional Name: 1-(2-butylphenyl)-3-(2,5-dichlorophenyl)thiourea Formula: C17H18Cl2N2S MolecularWeight: 353.30922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC=C1NC(=S)NC2=C(C=CC(=C2)Cl)Cl

Isomeric SMILES

CCCCC1=CC=CC=C1NC(=S)NC2=C(C=CC(=C2)Cl)Cl

InChI

InChI=1S/C17H18Cl2N2S/c1-2-3-6-12-7-4-5-8-15(12)20-17(22)21-16-11-13(18)9-10-14(16)19/h4-5,7-11H,2-3,6H2,1H3,(H2,20,21,22)