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

Systemtic Name: 1-[(2-imidazol-1-ylpyridin-3-yl)methyl]-3-[(2-morpholin-4-ylsulfonylphenyl)methyl]urea Openeye Name: 1-[(2-imidazol-1-yl-3-pyridyl)methyl]-3-[(2-morpholinosulfonylphenyl)methyl]urea CAS Name: 1-[[2-(1-imidazolyl)-3-pyridinyl]methyl]-3-[[2-(4-morpholinylsulfonyl)phenyl]methyl]urea IUPAC Name: 1-[(2-imidazol-1-ylpyridin-3-yl)methyl]-3-[(2-morpholin-4-ylsulfonylphenyl)methyl]urea Traditional Name: 1-[(2-imidazol-1-yl-3-pyridyl)methyl]-3-(2-morpholinosulfonylbenzyl)urea Formula: C21H24N6O4S MolecularWeight: 456.51806

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)NCC3=C(N=CC=C3)N4C=CN=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)NCC3=C(N=CC=C3)N4C=CN=C4

InChI

InChI=1S/C21H24N6O4S/c28-21(25-15-18-5-3-7-23-20(18)26-9-8-22-16-26)24-14-17-4-1-2-6-19(17)32(29,30)27-10-12-31-13-11-27/h1-9,16H,10-15H2,(H2,24,25,28)