1-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-[(1-phenylpyrazol-4-yl)methyl]urea

Systemtic Name: 1-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-[(1-phenylpyrazol-4-yl)methyl]urea Openeye Name: 1-[(2-morpholinosulfonylphenyl)methyl]-3-[(1-phenylpyrazol-4-yl)methyl]urea CAS Name: 1-[[2-(4-morpholinylsulfonyl)phenyl]methyl]-3-[(1-phenyl-4-pyrazolyl)methyl]urea IUPAC Name: 1-[(2-morpholin-4-ylsulfonylphenyl)methyl]-3-[(1-phenylpyrazol-4-yl)methyl]urea Traditional Name: 1-(2-morpholinosulfonylbenzyl)-3-[(1-phenylpyrazol-4-yl)methyl]urea Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)NCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)NCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5O4S/c28-22(23-14-18-15-25-27(17-18)20-7-2-1-3-8-20)24-16-19-6-4-5-9-21(19)32(29,30)26-10-12-31-13-11-26/h1-9,15,17H,10-14,16H2,(H2,23,24,28)