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

Systemtic Name: 1-(2-methylphenyl)-3-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]thiourea Openeye Name: 1-[4-[(2-methyl-1-piperidyl)sulfonyl]phenyl]-3-(o-tolyl)thiourea CAS Name: 1-(2-methylphenyl)-3-[4-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]thiourea IUPAC Name: 1-(2-methylphenyl)-3-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]thiourea Traditional Name: 1-[4-(2-methylpiperidino)sulfonylphenyl]-3-(o-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=CC=C3C

Isomeric SMILES

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

InChI

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