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

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[4-(2-ketopyrrolidino)benzyl]thiourea Formula: C19H20ClN3OS MolecularWeight: 373.8996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClN3OS/c1-13-4-7-15(11-17(13)20)22-19(25)21-12-14-5-8-16(9-6-14)23-10-2-3-18(23)24/h4-9,11H,2-3,10,12H2,1H3,(H2,21,22,25)