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

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-(4-methyl-2-piperidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[4-methyl-2-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[4-methyl-2-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-(4-methyl-2-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-(4-methyl-2-piperidinosulfonyl-phenyl)thiourea Formula: C20H24ClN3O2S2 MolecularWeight: 438.00646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24ClN3O2S2/c1-14-6-9-18(19(12-14)28(25,26)24-10-4-3-5-11-24)23-20(27)22-16-8-7-15(2)17(21)13-16/h6-9,12-13H,3-5,10-11H2,1-2H3,(H2,22,23,27)