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

Systemtic Name: 1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(4-methylphenyl)sulfonyl-urea Openeye Name: 1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(p-tolylsulfonyl)urea CAS Name: 1-[(3-fluorophenyl)methyl]-1-[3-(1-imidazolyl)propyl]-3-(4-methylphenyl)sulfonylurea IUPAC Name: 1-[(3-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-3-(4-methylphenyl)sulfonylurea Traditional Name: 1-(3-fluorobenzyl)-1-(3-imidazol-1-ylpropyl)-3-tosyl-urea Formula: C21H23FN4O3S MolecularWeight: 430.495723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N(CCCN2C=CN=C2)CC3=CC(=CC=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N(CCCN2C=CN=C2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C21H23FN4O3S/c1-17-6-8-20(9-7-17)30(28,29)24-21(27)26(12-3-11-25-13-10-23-16-25)15-18-4-2-5-19(22)14-18/h2,4-10,13-14,16H,3,11-12,15H2,1H3,(H,24,27)