1-(3,5-dimethylphenyl)-3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-[4-(2-ketopyrrolidino)benzyl]thiourea Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3OS/c1-14-10-15(2)12-17(11-14)22-20(25)21-13-16-5-7-18(8-6-16)23-9-3-4-19(23)24/h5-8,10-12H,3-4,9,13H2,1-2H3,(H2,21,22,25)