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

Systemtic Name: 1-(2-methylphenyl)-3-[4-[(2S)-2-methylpiperidin-1-yl]sulfonylphenyl]urea Openeye Name: 1-[4-[[(2S)-2-methyl-1-piperidyl]sulfonyl]phenyl]-3-(o-tolyl)urea CAS Name: 1-(2-methylphenyl)-3-[4-[[(2S)-2-methyl-1-piperidinyl]sulfonyl]phenyl]urea IUPAC Name: 1-(2-methylphenyl)-3-[4-[(2S)-2-methylpiperidin-1-yl]sulfonylphenyl]urea Traditional Name: 1-[4-[(2S)-2-methylpiperidino]sulfonylphenyl]-3-(o-tolyl)urea Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3C

Isomeric SMILES

C[C@H]1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C20H25N3O3S/c1-15-7-3-4-9-19(15)22-20(24)21-17-10-12-18(13-11-17)27(25,26)23-14-6-5-8-16(23)2/h3-4,7,9-13,16H,5-6,8,14H2,1-2H3,(H2,21,22,24)/t16-/m0/s1