2-[(3-azanyl-1,2-benzoxazol-5-yl)methyl]-4-oxidanylidene-4-pyrrolidin-1-yl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide

Systemtic Name: 2-[(3-azanyl-1,2-benzoxazol-5-yl)methyl]-4-oxidanylidene-4-pyrrolidin-1-yl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide Openeye Name: 2-[(3-amino-1,2-benzoxazol-5-yl)methyl]-4-oxo-4-pyrrolidin-1-yl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide CAS Name: 2-[(3-amino-1,2-benzoxazol-5-yl)methyl]-4-oxo-4-(1-pyrrolidinyl)-N-[4-(2-sulfamoylphenyl)phenyl]butanamide IUPAC Name: 2-[(3-amino-1,2-benzoxazol-5-yl)methyl]-4-oxo-4-pyrrolidin-1-yl-N-[4-(2-sulfamoylphenyl)phenyl]butanamide Traditional Name: 2-[(3-aminoindoxazen-5-yl)methyl]-4-keto-4-pyrrolidino-N-[4-(2-sulfamoylphenyl)phenyl]butyramide Formula: C28H29N5O5S MolecularWeight: 547.62536

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CC(CC2=CC3=C(C=C2)ON=C3N)C(=O)NC4=CC=C(C=C4)C5=CC=CC=C5S(=O)(=O)N

Isomeric SMILES

C1CCN(C1)C(=O)CC(CC2=CC3=C(C=C2)ON=C3N)C(=O)NC4=CC=C(C=C4)C5=CC=CC=C5S(=O)(=O)N

InChI

InChI=1S/C28H29N5O5S/c29-27-23-16-18(7-12-24(23)38-32-27)15-20(17-26(34)33-13-3-4-14-33)28(35)31-21-10-8-19(9-11-21)22-5-1-2-6-25(22)39(30,36)37/h1-2,5-12,16,20H,3-4,13-15,17H2,(H2,29,32)(H,31,35)(H2,30,36,37)