1-(4-propan-2-ylphenyl)-3-(4-pyrrolidin-1-ylcarbonylphenyl)thiourea

Systemtic Name: 1-(4-propan-2-ylphenyl)-3-(4-pyrrolidin-1-ylcarbonylphenyl)thiourea Openeye Name: 1-(4-isopropylphenyl)-3-[4-(pyrrolidine-1-carbonyl)phenyl]thiourea CAS Name: 1-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-(4-propan-2-ylphenyl)-3-[4-(pyrrolidine-1-carbonyl)phenyl]thiourea Traditional Name: 1-p-cumenyl-3-[4-(pyrrolidine-1-carbonyl)phenyl]thiourea Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCCC3

InChI

InChI=1S/C21H25N3OS/c1-15(2)16-5-9-18(10-6-16)22-21(26)23-19-11-7-17(8-12-19)20(25)24-13-3-4-14-24/h5-12,15H,3-4,13-14H2,1-2H3,(H2,22,23,26)