ethyl (2S)-4-methyl-2-[[4-[(2-phenyl-1,2-dihydroimidazol-3-yl)methyl]phenyl]sulfonylamino]pentanoate

Systemtic Name: ethyl (2S)-4-methyl-2-[[4-[(2-phenyl-1,2-dihydroimidazol-3-yl)methyl]phenyl]sulfonylamino]pentanoate Openeye Name: ethyl (2S)-4-methyl-2-[[4-[(2-phenyl-1,2-dihydroimidazol-3-yl)methyl]phenyl]sulfonylamino]pentanoate CAS Name: (2S)-4-methyl-2-[[4-[(2-phenyl-1,2-dihydroimidazol-3-yl)methyl]phenyl]sulfonylamino]pentanoic acid ethyl ester IUPAC Name: ethyl (2S)-4-methyl-2-[[4-[(2-phenyl-1,2-dihydroimidazol-3-yl)methyl]phenyl]sulfonylamino]pentanoate Traditional Name: (2S)-4-methyl-2-[[4-[(2-phenyl-4-imidazolin-1-yl)methyl]phenyl]sulfonylamino]valeric acid ethyl ester Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)CN2C=CNC2C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@H](CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)CN2C=CNC2C3=CC=CC=C3

InChI

InChI=1S/C24H31N3O4S/c1-4-31-24(28)22(16-18(2)3)26-32(29,30)21-12-10-19(11-13-21)17-27-15-14-25-23(27)20-8-6-5-7-9-20/h5-15,18,22-23,25-26H,4,16-17H2,1-3H3/t22-,23?/m0/s1