(2S)-N-[(4-chlorophenyl)methyl]-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxy-propanamide

Systemtic Name: (2S)-N-[(4-chlorophenyl)methyl]-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxy-propanamide Openeye Name: (2S)-N-[(4-chlorophenyl)methyl]-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-propanamide CAS Name: (2S)-N-[(4-chlorophenyl)methyl]-2-[[6-(4-morpholinylsulfonyl)-1-benzotriazolyl]oxy]propanamide IUPAC Name: (2S)-N-[(4-chlorophenyl)methyl]-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxypropanamide Traditional Name: (2S)-N-(4-chlorobenzyl)-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-propionamide Formula: C20H22ClN5O5S MolecularWeight: 479.93718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)Cl)ON2C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N=N2

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=C(C=C1)Cl)ON2C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N=N2

InChI

InChI=1S/C20H22ClN5O5S/c1-14(20(27)22-13-15-2-4-16(21)5-3-15)31-26-19-12-17(6-7-18(19)23-24-26)32(28,29)25-8-10-30-11-9-25/h2-7,12,14H,8-11,13H2,1H3,(H,22,27)/t14-/m0/s1