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

Systemtic Name: 1-(2-cyanoethyl)-3-[4-methyl-5-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]urea Openeye Name: 1-(2-cyanoethyl)-3-[4-methyl-5-(4-methylsulfonylphenyl)thiazol-2-yl]urea CAS Name: 1-(2-cyanoethyl)-3-[4-methyl-5-(4-methylsulfonylphenyl)-2-thiazolyl]urea IUPAC Name: 1-(2-cyanoethyl)-3-[4-methyl-5-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]urea Traditional Name: 1-(2-cyanoethyl)-3-[5-(4-mesylphenyl)-4-methyl-thiazol-2-yl]urea Formula: C15H16N4O3S2 MolecularWeight: 364.44254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)NCCC#N)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)NCCC#N)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C15H16N4O3S2/c1-10-13(11-4-6-12(7-5-11)24(2,21)22)23-15(18-10)19-14(20)17-9-3-8-16/h4-7H,3,9H2,1-2H3,(H2,17,18,19,20)