1-(4-ethoxyphenyl)-3-(4-methyl-2-piperidin-1-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-(4-ethoxyphenyl)-3-(4-methyl-2-piperidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(4-ethoxyphenyl)-3-[4-methyl-2-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-(4-ethoxyphenyl)-3-[4-methyl-2-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(4-ethoxyphenyl)-3-(4-methyl-2-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(4-methyl-2-piperidinosulfonyl-phenyl)-3-p-phenetyl-thiourea Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NC2=C(C=C(C=C2)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC2=C(C=C(C=C2)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H27N3O3S2/c1-3-27-18-10-8-17(9-11-18)22-21(28)23-19-12-7-16(2)15-20(19)29(25,26)24-13-5-4-6-14-24/h7-12,15H,3-6,13-14H2,1-2H3,(H2,22,23,28)