1-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(4-methylsulfanylphenyl)urea

Systemtic Name: 1-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(4-methylsulfanylphenyl)urea Openeye Name: 1-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(4-methylsulfanylphenyl)urea CAS Name: 1-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl]-1-cyclohexyl-3-[4-(methylthio)phenyl]urea IUPAC Name: 1-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(4-methylsulfanylphenyl)urea Traditional Name: 1-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl]-1-cyclohexyl-3-[4-(methylthio)phenyl]urea Formula: C26H30ClN3OS MolecularWeight: 468.0539

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)N(CC2=CC=CN2CC3=CC=CC=C3Cl)C4CCCCC4

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)N(CC2=CC=CN2CC3=CC=CC=C3Cl)C4CCCCC4

InChI

InChI=1S/C26H30ClN3OS/c1-32-24-15-13-21(14-16-24)28-26(31)30(22-9-3-2-4-10-22)19-23-11-7-17-29(23)18-20-8-5-6-12-25(20)27/h5-8,11-17,22H,2-4,9-10,18-19H2,1H3,(H,28,31)