3-(3-methoxypropyl)-1-methyl-1-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]thiourea

Systemtic Name: 3-(3-methoxypropyl)-1-methyl-1-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]thiourea Openeye Name: 3-(3-methoxypropyl)-1-methyl-1-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]thiourea CAS Name: 3-(3-methoxypropyl)-1-methyl-1-[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]thiourea IUPAC Name: 3-(3-methoxypropyl)-1-methyl-1-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]thiourea Traditional Name: 3-(3-methoxypropyl)-1-methyl-1-[(3-pyrrolidinosulfonylbenzoyl)amino]thiourea Formula: C17H26N4O4S2 MolecularWeight: 414.54274

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCCCOC)NC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CN(C(=S)NCCCOC)NC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C17H26N4O4S2/c1-20(17(26)18-9-6-12-25-2)19-16(22)14-7-5-8-15(13-14)27(23,24)21-10-3-4-11-21/h5,7-8,13H,3-4,6,9-12H2,1-2H3,(H,18,26)(H,19,22)