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

Systemtic Name: 1-(3-methylphenyl)-3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]thiourea Openeye Name: 1-(m-tolyl)-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]thiourea CAS Name: 1-(3-methylphenyl)-3-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]thiourea IUPAC Name: 1-(3-methylphenyl)-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]thiourea Traditional Name: 1-[4-(2-ketopyrrolidino)benzyl]-3-(m-tolyl)thiourea Formula: C19H21N3OS MolecularWeight: 339.45454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NCC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NCC2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C19H21N3OS/c1-14-4-2-5-16(12-14)21-19(24)20-13-15-7-9-17(10-8-15)22-11-3-6-18(22)23/h2,4-5,7-10,12H,3,6,11,13H2,1H3,(H2,20,21,24)