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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2=CC=CC=C2C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2=CC=CC=C2C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H25N3O2S2/c1-15-8-4-5-9-18(15)22-20(26)21-17-11-10-16(2)19(14-17)27(24,25)23-12-6-3-7-13-23/h4-5,8-11,14H,3,6-7,12-13H2,1-2H3,(H2,21,22,26)