1-(4-methylphenyl)-3-[4-[(2S)-2-methylpiperidin-1-yl]sulfonylphenyl]thiourea

Systemtic Name: 1-(4-methylphenyl)-3-[4-[(2S)-2-methylpiperidin-1-yl]sulfonylphenyl]thiourea Openeye Name: 1-[4-[[(2S)-2-methyl-1-piperidyl]sulfonyl]phenyl]-3-(p-tolyl)thiourea CAS Name: 1-(4-methylphenyl)-3-[4-[[(2S)-2-methyl-1-piperidinyl]sulfonyl]phenyl]thiourea IUPAC Name: 1-(4-methylphenyl)-3-[4-[(2S)-2-methylpiperidin-1-yl]sulfonylphenyl]thiourea Traditional Name: 1-[4-[(2S)-2-methylpiperidino]sulfonylphenyl]-3-(p-tolyl)thiourea Formula: C20H25N3O2S2 MolecularWeight: 403.5614

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)C

Isomeric SMILES

C[C@H]1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)C

InChI

InChI=1S/C20H25N3O2S2/c1-15-6-8-17(9-7-15)21-20(26)22-18-10-12-19(13-11-18)27(24,25)23-14-4-3-5-16(23)2/h6-13,16H,3-5,14H2,1-2H3,(H2,21,22,26)/t16-/m0/s1