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

Systemtic Name: 1-(3-methylphenyl)-3-(4-methyl-2-piperidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-[4-methyl-2-(1-piperidylsulfonyl)phenyl]-3-(m-tolyl)thiourea CAS Name: 1-(3-methylphenyl)-3-[4-methyl-2-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(3-methylphenyl)-3-(4-methyl-2-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(4-methyl-2-piperidinosulfonyl-phenyl)-3-(m-tolyl)thiourea Formula: C20H25N3O2S2 MolecularWeight: 403.5614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O2S2/c1-15-7-6-8-17(13-15)21-20(26)22-18-10-9-16(2)14-19(18)27(24,25)23-11-4-3-5-12-23/h6-10,13-14H,3-5,11-12H2,1-2H3,(H2,21,22,26)