N-[(4-methoxyphenyl)methyl]-1-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]pyrrolidine-2-carboxamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-1-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]pyrrolidine-2-carboxamide Openeye Name: N-[(4-methoxyphenyl)methyl]-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]pyrrolidine-2-carboxamide CAS Name: N-[(4-methoxyphenyl)methyl]-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]pyrrolidine-2-carboxamide Traditional Name: 1-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]-N-p-anisyl-pyrrolidine-2-carboxamide Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

InChI

InChI=1S/C23H27N3O5S/c1-31-18-9-7-16(8-10-18)15-24-23(28)21-5-3-13-26(21)32(29,30)19-11-12-20-17(14-19)4-2-6-22(27)25-20/h7-12,14,21H,2-6,13,15H2,1H3,(H,24,28)(H,25,27)