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

Systemtic Name: 1-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-(4-methyl-3-piperidinosulfonyl-phenyl)-3-[3-(methylthio)propyl]thiourea Formula: C17H27N3O2S3 MolecularWeight: 401.61018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCCCSC)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCCCSC)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C17H27N3O2S3/c1-14-7-8-15(19-17(23)18-9-6-12-24-2)13-16(14)25(21,22)20-10-4-3-5-11-20/h7-8,13H,3-6,9-12H2,1-2H3,(H2,18,19,23)