1-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-3-[3-(methylthio)propyl]thiourea Formula: C17H27N3O3S3 MolecularWeight: 417.60958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=S)NCCCSC)S(=O)(=O)N2CCCC2

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=S)NCCCSC)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C17H27N3O3S3/c1-3-23-15-8-7-14(19-17(24)18-9-6-12-25-2)13-16(15)26(21,22)20-10-4-5-11-20/h7-8,13H,3-6,9-12H2,1-2H3,(H2,18,19,24)