3-(4-bromanyl-2-chloranyl-phenyl)-1,1-dipentyl-thiourea

Systemtic Name: 3-(4-bromanyl-2-chloranyl-phenyl)-1,1-dipentyl-thiourea Openeye Name: 3-(4-bromo-2-chloro-phenyl)-1,1-dipentyl-thiourea CAS Name: 3-(4-bromo-2-chlorophenyl)-1,1-dipentylthiourea IUPAC Name: 3-(4-bromo-2-chlorophenyl)-1,1-dipentylthiourea Traditional Name: 1,1-diamyl-3-(4-bromo-2-chloro-phenyl)thiourea Formula: C17H26BrClN2S MolecularWeight: 405.82374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=S)NC1=C(C=C(C=C1)Br)Cl

Isomeric SMILES

CCCCCN(CCCCC)C(=S)NC1=C(C=C(C=C1)Br)Cl

InChI

InChI=1S/C17H26BrClN2S/c1-3-5-7-11-21(12-8-6-4-2)17(22)20-16-10-9-14(18)13-15(16)19/h9-10,13H,3-8,11-12H2,1-2H3,(H,20,22)