1-[(3-bromanyl-2-oxidanyl-phenyl)methyl]-1-butyl-3-phenyl-thiourea

Systemtic Name: 1-[(3-bromanyl-2-oxidanyl-phenyl)methyl]-1-butyl-3-phenyl-thiourea Openeye Name: 1-[(3-bromo-2-hydroxy-phenyl)methyl]-1-butyl-3-phenyl-thiourea CAS Name: 1-[(3-bromo-2-hydroxyphenyl)methyl]-1-butyl-3-phenylthiourea IUPAC Name: 1-[(3-bromo-2-hydroxyphenyl)methyl]-1-butyl-3-phenylthiourea Traditional Name: 1-(3-bromo-2-hydroxy-benzyl)-1-butyl-3-phenyl-thiourea Formula: C18H21BrN2OS MolecularWeight: 393.34114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=C(C(=CC=C1)Br)O)C(=S)NC2=CC=CC=C2

Isomeric SMILES

CCCCN(CC1=C(C(=CC=C1)Br)O)C(=S)NC2=CC=CC=C2

InChI

InChI=1S/C18H21BrN2OS/c1-2-3-12-21(13-14-8-7-11-16(19)17(14)22)18(23)20-15-9-5-4-6-10-15/h4-11,22H,2-3,12-13H2,1H3,(H,20,23)