1-[5-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-pyrrol-3-yl]pentyl]urea

Systemtic Name: 1-[5-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-pyrrol-3-yl]pentyl]urea Openeye Name: 5-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-pyrrol-3-yl]pentylurea CAS Name: 5-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-3-pyrrolyl]pentylurea IUPAC Name: 5-[2-methyl-5-(4-methylsulfonylphenyl)-1-phenylpyrrol-3-yl]pentylurea Traditional Name: 5-[5-(4-mesylphenyl)-2-methyl-1-phenyl-pyrrol-3-yl]pentylurea Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C)CCCCCNC(=O)N

Isomeric SMILES

CC1=C(C=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C)CCCCCNC(=O)N

InChI

InChI=1S/C24H29N3O3S/c1-18-20(9-5-4-8-16-26-24(25)28)17-23(27(18)21-10-6-3-7-11-21)19-12-14-22(15-13-19)31(2,29)30/h3,6-7,10-15,17H,4-5,8-9,16H2,1-2H3,(H3,25,26,28)