1-[4-(dimethylamino)-3-pyrrolidin-1-ylcarbonyl-phenyl]-3-(4-methylsulfanylphenyl)urea

Systemtic Name: 1-[4-(dimethylamino)-3-pyrrolidin-1-ylcarbonyl-phenyl]-3-(4-methylsulfanylphenyl)urea Openeye Name: 1-[4-(dimethylamino)-3-(pyrrolidine-1-carbonyl)phenyl]-3-(4-methylsulfanylphenyl)urea CAS Name: 1-[4-(dimethylamino)-3-[oxo(1-pyrrolidinyl)methyl]phenyl]-3-[4-(methylthio)phenyl]urea IUPAC Name: 1-[4-(dimethylamino)-3-(pyrrolidine-1-carbonyl)phenyl]-3-(4-methylsulfanylphenyl)urea Traditional Name: 1-[4-(dimethylamino)-3-(pyrrolidine-1-carbonyl)phenyl]-3-[4-(methylthio)phenyl]urea Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)NC(=O)NC2=CC=C(C=C2)SC)C(=O)N3CCCC3

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)NC(=O)NC2=CC=C(C=C2)SC)C(=O)N3CCCC3

InChI

InChI=1S/C21H26N4O2S/c1-24(2)19-11-8-16(14-18(19)20(26)25-12-4-5-13-25)23-21(27)22-15-6-9-17(28-3)10-7-15/h6-11,14H,4-5,12-13H2,1-3H3,(H2,22,23,27)