1-(3,5-dimethylphenyl)-3-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-[4-(3-methylpiperidino)sulfonylphenyl]thiourea Formula: C21H27N3O2S2 MolecularWeight: 417.58798

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC(=CC(=C3)C)C

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C21H27N3O2S2/c1-15-5-4-10-24(14-15)28(25,26)20-8-6-18(7-9-20)22-21(27)23-19-12-16(2)11-17(3)13-19/h6-9,11-13,15H,4-5,10,14H2,1-3H3,(H2,22,23,27)