1-(2-methylquinolin-4-yl)-3-[2-[3-(thiophen-2-ylsulfonylamino)pyrrolidin-1-yl]ethyl]urea

Systemtic Name: 1-(2-methylquinolin-4-yl)-3-[2-[3-(thiophen-2-ylsulfonylamino)pyrrolidin-1-yl]ethyl]urea Openeye Name: 1-(2-methyl-4-quinolyl)-3-[2-[3-(2-thienylsulfonylamino)pyrrolidin-1-yl]ethyl]urea CAS Name: 1-(2-methyl-4-quinolinyl)-3-[2-[3-(thiophen-2-ylsulfonylamino)-1-pyrrolidinyl]ethyl]urea IUPAC Name: 1-(2-methylquinolin-4-yl)-3-[2-[3-(thiophen-2-ylsulfonylamino)pyrrolidin-1-yl]ethyl]urea Traditional Name: 1-(2-methyl-4-quinolyl)-3-[2-[3-(2-thienylsulfonylamino)pyrrolidino]ethyl]urea Formula: C21H25N5O3S2 MolecularWeight: 459.5849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCC(C3)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCC(C3)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H25N5O3S2/c1-15-13-19(17-5-2-3-6-18(17)23-15)24-21(27)22-9-11-26-10-8-16(14-26)25-31(28,29)20-7-4-12-30-20/h2-7,12-13,16,25H,8-11,14H2,1H3,(H2,22,23,24,27)