1-(4-chloranyl-2-cyano-phenyl)-3-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)urea

Systemtic Name: 1-(4-chloranyl-2-cyano-phenyl)-3-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)urea Openeye Name: 1-(4-chloro-2-cyano-phenyl)-3-[4-methyl-3-(1-piperidylsulfonyl)phenyl]urea CAS Name: 1-(4-chloro-2-cyanophenyl)-3-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]urea IUPAC Name: 1-(4-chloro-2-cyanophenyl)-3-(4-methyl-3-piperidin-1-ylsulfonylphenyl)urea Traditional Name: 1-(4-chloro-2-cyano-phenyl)-3-(4-methyl-3-piperidinosulfonyl-phenyl)urea Formula: C20H21ClN4O3S MolecularWeight: 432.92374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=C(C=C(C=C2)Cl)C#N)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=C(C=C(C=C2)Cl)C#N)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H21ClN4O3S/c1-14-5-7-17(12-19(14)29(27,28)25-9-3-2-4-10-25)23-20(26)24-18-8-6-16(21)11-15(18)13-22/h5-8,11-12H,2-4,9-10H2,1H3,(H2,23,24,26)