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

Systemtic Name: 1-[2,5-bis(chloranyl)phenyl]-3-heptan-2-yl-thiourea Openeye Name: 1-(2,5-dichlorophenyl)-3-(1-methylhexyl)thiourea CAS Name: 1-(2,5-dichlorophenyl)-3-heptan-2-ylthiourea IUPAC Name: 1-(2,5-dichlorophenyl)-3-heptan-2-ylthiourea Traditional Name: 1-(2,5-dichlorophenyl)-3-(1-methylhexyl)thiourea Formula: C14H20Cl2N2S MolecularWeight: 319.293

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=S)NC1=C(C=CC(=C1)Cl)Cl

Isomeric SMILES

CCCCCC(C)NC(=S)NC1=C(C=CC(=C1)Cl)Cl

InChI

InChI=1S/C14H20Cl2N2S/c1-3-4-5-6-10(2)17-14(19)18-13-9-11(15)7-8-12(13)16/h7-10H,3-6H2,1-2H3,(H2,17,18,19)