3-(4-bromanyl-3-chloranyl-phenyl)-1-(2-cyanoethyl)-1-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 3-(4-bromanyl-3-chloranyl-phenyl)-1-(2-cyanoethyl)-1-(oxolan-2-ylmethyl)thiourea Openeye Name: 3-(4-bromo-3-chloro-phenyl)-1-(2-cyanoethyl)-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 3-(4-bromo-3-chlorophenyl)-1-(2-cyanoethyl)-1-(2-oxolanylmethyl)thiourea IUPAC Name: 3-(4-bromo-3-chlorophenyl)-1-(2-cyanoethyl)-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-(4-bromo-3-chloro-phenyl)-1-(2-cyanoethyl)-1-(tetrahydrofurfuryl)thiourea Formula: C15H17BrClN3OS MolecularWeight: 402.73698

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CCC#N)C(=S)NC2=CC(=C(C=C2)Br)Cl

Isomeric SMILES

C1CC(OC1)CN(CCC#N)C(=S)NC2=CC(=C(C=C2)Br)Cl

InChI

InChI=1S/C15H17BrClN3OS/c16-13-5-4-11(9-14(13)17)19-15(22)20(7-2-6-18)10-12-3-1-8-21-12/h4-5,9,12H,1-3,7-8,10H2,(H,19,22)