1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]-3-(4-methylphenyl)sulfonyl-urea

Systemtic Name: 1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]-3-(4-methylphenyl)sulfonyl-urea Openeye Name: 1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]-3-(p-tolylsulfonyl)urea CAS Name: 1-[3-(1-imidazolyl)propyl]-1-[(2-methoxyphenyl)methyl]-3-(4-methylphenyl)sulfonylurea IUPAC Name: 1-(3-imidazol-1-ylpropyl)-1-[(2-methoxyphenyl)methyl]-3-(4-methylphenyl)sulfonylurea Traditional Name: 1-(3-imidazol-1-ylpropyl)-1-o-anisyl-3-tosyl-urea Formula: C22H26N4O4S MolecularWeight: 442.53124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N(CCCN2C=CN=C2)CC3=CC=CC=C3OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N(CCCN2C=CN=C2)CC3=CC=CC=C3OC

InChI

InChI=1S/C22H26N4O4S/c1-18-8-10-20(11-9-18)31(28,29)24-22(27)26(14-5-13-25-15-12-23-17-25)16-19-6-3-4-7-21(19)30-2/h3-4,6-12,15,17H,5,13-14,16H2,1-2H3,(H,24,27)