1-(4-bromanyl-3-methyl-phenyl)-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]thiourea

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]thiourea Openeye Name: 1-(4-bromo-3-methyl-phenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]thiourea CAS Name: 1-(4-bromo-3-methylphenyl)-3-[3-(2-oxo-1-pyrrolidinyl)propyl]thiourea IUPAC Name: 1-(4-bromo-3-methylphenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]thiourea Traditional Name: 1-(4-bromo-3-methyl-phenyl)-3-[3-(2-ketopyrrolidino)propyl]thiourea Formula: C15H20BrN3OS MolecularWeight: 370.3078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)NCCCN2CCCC2=O)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)NCCCN2CCCC2=O)Br

InChI

InChI=1S/C15H20BrN3OS/c1-11-10-12(5-6-13(11)16)18-15(21)17-7-3-9-19-8-2-4-14(19)20/h5-6,10H,2-4,7-9H2,1H3,(H2,17,18,21)