1-phenethyl-3-(4-piperidin-1-ylsulfonylphenyl)thiourea

Systemtic Name: 1-phenethyl-3-(4-piperidin-1-ylsulfonylphenyl)thiourea Openeye Name: 1-phenethyl-3-[4-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-phenethyl-3-[4-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-phenethyl-3-(4-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-phenethyl-3-(4-piperidinosulfonylphenyl)thiourea Formula: C20H25N3O2S2 MolecularWeight: 403.5614

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCCC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O2S2/c24-27(25,23-15-5-2-6-16-23)19-11-9-18(10-12-19)22-20(26)21-14-13-17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-16H2,(H2,21,22,26)