ethyl 2-[1-[(2-ethanoylsulfanyl-3,4-dimethyl-pentanoyl)amino]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]ethanoate

Systemtic Name: ethyl 2-[1-[(2-ethanoylsulfanyl-3,4-dimethyl-pentanoyl)amino]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-3-yl]ethanoate Openeye Name: ethyl 2-[1-[(2-acetylsulfanyl-3,4-dimethyl-pentanoyl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]acetate CAS Name: 2-[1-[[2-(acetylthio)-3,4-dimethyl-1-oxopentyl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[(2-acetylsulfanyl-3,4-dimethylpentanoyl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]acetate Traditional Name: 2-[1-[[2-(acetylthio)-3,4-dimethyl-pentanoyl]amino]-2-keto-4,5-dihydro-3H-1-benzazepin-3-yl]acetic acid ethyl ester Formula: C23H32N2O5S MolecularWeight: 448.57558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CCC2=CC=CC=C2N(C1=O)NC(=O)C(C(C)C(C)C)SC(=O)C

Isomeric SMILES

CCOC(=O)CC1CCC2=CC=CC=C2N(C1=O)NC(=O)C(C(C)C(C)C)SC(=O)C

InChI

InChI=1S/C23H32N2O5S/c1-6-30-20(27)13-18-12-11-17-9-7-8-10-19(17)25(23(18)29)24-22(28)21(31-16(5)26)15(4)14(2)3/h7-10,14-15,18,21H,6,11-13H2,1-5H3,(H,24,28)