1-[4-methyl-5-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]-3-(4-oxidanylbutyl)urea

Systemtic Name: 1-[4-methyl-5-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]-3-(4-oxidanylbutyl)urea Openeye Name: 1-(4-hydroxybutyl)-3-[4-methyl-5-(4-methylsulfonylphenyl)thiazol-2-yl]urea CAS Name: 1-(4-hydroxybutyl)-3-[4-methyl-5-(4-methylsulfonylphenyl)-2-thiazolyl]urea IUPAC Name: 1-(4-hydroxybutyl)-3-[4-methyl-5-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]urea Traditional Name: 1-(4-hydroxybutyl)-3-[5-(4-mesylphenyl)-4-methyl-thiazol-2-yl]urea Formula: C16H21N3O4S2 MolecularWeight: 383.48564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)NCCCCO)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)NCCCCO)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C16H21N3O4S2/c1-11-14(12-5-7-13(8-6-12)25(2,22)23)24-16(18-11)19-15(21)17-9-3-4-10-20/h5-8,20H,3-4,9-10H2,1-2H3,(H2,17,18,19,21)