1-(2-methylphenyl)-3-(4-piperidin-1-ylsulfonylphenyl)thiourea

Systemtic Name: 1-(2-methylphenyl)-3-(4-piperidin-1-ylsulfonylphenyl)thiourea Openeye Name: 1-(o-tolyl)-3-[4-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-(2-methylphenyl)-3-[4-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(2-methylphenyl)-3-(4-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(o-tolyl)-3-(4-piperidinosulfonylphenyl)thiourea Formula: C19H23N3O2S2 MolecularWeight: 389.53482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H23N3O2S2/c1-15-7-3-4-8-18(15)21-19(25)20-16-9-11-17(12-10-16)26(23,24)22-13-5-2-6-14-22/h3-4,7-12H,2,5-6,13-14H2,1H3,(H2,20,21,25)