ethyl 2-[3-[ethanoylsulfanyl(3-phenylpropanoyl)amino]-2-oxidanylidene-5H-1-benzazepin-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-[ethanoylsulfanyl(3-phenylpropanoyl)amino]-2-oxidanylidene-5H-1-benzazepin-1-yl]ethanoate Openeye Name: ethyl 2-[3-[acetylsulfanyl(3-phenylpropanoyl)amino]-2-oxo-5H-1-benzazepin-1-yl]acetate CAS Name: 2-[3-[(acetylthio)-(1-oxo-3-phenylpropyl)amino]-2-oxo-5H-1-benzazepin-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[acetylsulfanyl(3-phenylpropanoyl)amino]-2-oxo-5H-1-benzazepin-1-yl]acetate Traditional Name: 2-[3-[(acetylthio)-hydrocinnamoyl-amino]-2-keto-5H-1-benzazepin-1-yl]acetic acid ethyl ester Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2CC=C(C1=O)N(C(=O)CCC3=CC=CC=C3)SC(=O)C

Isomeric SMILES

CCOC(=O)CN1C2=CC=CC=C2CC=C(C1=O)N(C(=O)CCC3=CC=CC=C3)SC(=O)C

InChI

InChI=1S/C25H26N2O5S/c1-3-32-24(30)17-26-21-12-8-7-11-20(21)14-15-22(25(26)31)27(33-18(2)28)23(29)16-13-19-9-5-4-6-10-19/h4-12,15H,3,13-14,16-17H2,1-2H3