1-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-3-(3-phenylsulfanylpropyl)urea

Systemtic Name: 1-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-3-(3-phenylsulfanylpropyl)urea Openeye Name: 1-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-3-(3-phenylsulfanylpropyl)urea CAS Name: 1-[(4-chlorophenyl)-(1-methyl-2-imidazolyl)methyl]-3-[3-(phenylthio)propyl]urea IUPAC Name: 1-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-3-(3-phenylsulfanylpropyl)urea Traditional Name: 1-[(4-chlorophenyl)-(1-methylimidazol-2-yl)methyl]-3-[3-(phenylthio)propyl]urea Formula: C21H23ClN4OS MolecularWeight: 414.95152

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=C(C=C2)Cl)NC(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

CN1C=CN=C1C(C2=CC=C(C=C2)Cl)NC(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C21H23ClN4OS/c1-26-14-13-23-20(26)19(16-8-10-17(22)11-9-16)25-21(27)24-12-5-15-28-18-6-3-2-4-7-18/h2-4,6-11,13-14,19H,5,12,15H2,1H3,(H2,24,25,27)