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

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

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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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O2S2/c1-15-5-3-7-18(13-15)22-20(26)21-17-8-10-19(11-9-17)27(24,25)23-12-4-6-16(2)14-23/h3,5,7-11,13,16H,4,6,12,14H2,1-2H3,(H2,21,22,26)