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

Systemtic Name: 1-[2,3-bis(chloranyl)phenyl]-3-octan-2-yl-thiourea Openeye Name: 1-(2,3-dichlorophenyl)-3-(1-methylheptyl)thiourea CAS Name: 1-(2,3-dichlorophenyl)-3-octan-2-ylthiourea IUPAC Name: 1-(2,3-dichlorophenyl)-3-octan-2-ylthiourea Traditional Name: 1-(2,3-dichlorophenyl)-3-(1-methylheptyl)thiourea Formula: C15H22Cl2N2S MolecularWeight: 333.31958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22Cl2N2S/c1-3-4-5-6-8-11(2)18-15(20)19-13-10-7-9-12(16)14(13)17/h7,9-11H,3-6,8H2,1-2H3,(H2,18,19,20)