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

Systemtic Name: 1-(4-propan-2-ylphenyl)-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea Openeye Name: 1-(4-isopropylphenyl)-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea CAS Name: 1-(4-propan-2-ylphenyl)-3-[3-(1-pyrrolidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(4-propan-2-ylphenyl)-3-(3-pyrrolidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-p-cumenyl-3-(3-pyrrolidinosulfonylphenyl)thiourea Formula: C20H25N3O2S2 MolecularWeight: 403.5614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O2S2/c1-15(2)16-8-10-17(11-9-16)21-20(26)22-18-6-5-7-19(14-18)27(24,25)23-12-3-4-13-23/h5-11,14-15H,3-4,12-13H2,1-2H3,(H2,21,22,26)