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

Systemtic Name: 1-(4-ethanoylphenyl)-3-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]thiourea Openeye Name: 1-(4-acetylphenyl)-3-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]thiourea CAS Name: 1-(4-acetylphenyl)-3-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]thiourea IUPAC Name: 1-(4-acetylphenyl)-3-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]thiourea Traditional Name: 1-(4-acetylphenyl)-3-[4-(4-methylpiperidino)sulfonylphenyl]thiourea Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H25N3O3S2/c1-15-11-13-24(14-12-15)29(26,27)20-9-7-19(8-10-20)23-21(28)22-18-5-3-17(4-6-18)16(2)25/h3-10,15H,11-14H2,1-2H3,(H2,22,23,28)