(2S)-2-(aminocarbonylamino)-4-methyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]pentanamide

Systemtic Name: (2S)-2-(aminocarbonylamino)-4-methyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]pentanamide Openeye Name: (2S)-4-methyl-N-[(4-morpholinosulfonylphenyl)methyl]-2-ureido-pentanamide CAS Name: (2S)-2-(carbamoylamino)-4-methyl-N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]pentanamide IUPAC Name: (2S)-2-(carbamoylamino)-4-methyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]pentanamide Traditional Name: (2S)-4-methyl-N-(4-morpholinosulfonylbenzyl)-2-ureido-valeramide Formula: C18H28N4O5S MolecularWeight: 412.50372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)NCC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)N

InChI

InChI=1S/C18H28N4O5S/c1-13(2)11-16(21-18(19)24)17(23)20-12-14-3-5-15(6-4-14)28(25,26)22-7-9-27-10-8-22/h3-6,13,16H,7-12H2,1-2H3,(H,20,23)(H3,19,21,24)/t16-/m0/s1