1-butyl-3-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-butyl-3-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-butyl-3-[4-methyl-3-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-butyl-3-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-butyl-3-(4-methyl-3-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-butyl-3-(4-methyl-3-piperidinosulfonyl-phenyl)thiourea Formula: C17H27N3O2S2 MolecularWeight: 369.54518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CC(=C(C=C1)C)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CCCCNC(=S)NC1=CC(=C(C=C1)C)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C17H27N3O2S2/c1-3-4-10-18-17(23)19-15-9-8-14(2)16(13-15)24(21,22)20-11-6-5-7-12-20/h8-9,13H,3-7,10-12H2,1-2H3,(H2,18,19,23)