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

Systemtic Name: (2S)-N-[(2-methoxyphenyl)methyl]-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxy-propanamide Openeye Name: (2S)-N-[(2-methoxyphenyl)methyl]-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-propanamide CAS Name: (2S)-N-[(2-methoxyphenyl)methyl]-2-[[6-(4-morpholinylsulfonyl)-1-benzotriazolyl]oxy]propanamide IUPAC Name: (2S)-N-[(2-methoxyphenyl)methyl]-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxypropanamide Traditional Name: (2S)-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-N-o-anisyl-propionamide Formula: C21H25N5O6S MolecularWeight: 475.5181

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1OC)ON2C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N=N2

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CC=C1OC)ON2C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N=N2

InChI

InChI=1S/C21H25N5O6S/c1-15(21(27)22-14-16-5-3-4-6-20(16)30-2)32-26-19-13-17(7-8-18(19)23-24-26)33(28,29)25-9-11-31-12-10-25/h3-8,13,15H,9-12,14H2,1-2H3,(H,22,27)/t15-/m0/s1