azanyl 2-[4-[(4-methoxyphenyl)methyl]-3-(2-methyl-3-phenyl-3-sulfanylidene-propanoyl)-2-oxidanylidene-5H-1-benzazepin-1-yl]ethanoate

Systemtic Name: azanyl 2-[4-[(4-methoxyphenyl)methyl]-3-(2-methyl-3-phenyl-3-sulfanylidene-propanoyl)-2-oxidanylidene-5H-1-benzazepin-1-yl]ethanoate Openeye Name: amino 2-[4-[(4-methoxyphenyl)methyl]-3-(2-methyl-3-phenyl-3-thioxo-propanoyl)-2-oxo-5H-1-benzazepin-1-yl]acetate CAS Name: 2-[4-[(4-methoxyphenyl)methyl]-3-(2-methyl-1-oxo-3-phenyl-3-sulfanylidenepropyl)-2-oxo-5H-1-benzazepin-1-yl]acetic acid amino ester IUPAC Name: amino 2-[4-[(4-methoxyphenyl)methyl]-3-(2-methyl-3-phenyl-3-sulfanylidenepropanoyl)-2-oxo-5H-1-benzazepin-1-yl]acetate Traditional Name: 2-[2-keto-3-(2-methyl-3-phenyl-3-thioxo-propanoyl)-4-p-anisyl-5H-1-benzazepin-1-yl]acetic acid amino ester Formula: C30H28N2O5S MolecularWeight: 528.61872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=S)C1=CC=CC=C1)C(=O)C2=C(CC3=CC=CC=C3N(C2=O)CC(=O)ON)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC(C(=S)C1=CC=CC=C1)C(=O)C2=C(CC3=CC=CC=C3N(C2=O)CC(=O)ON)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C30H28N2O5S/c1-19(29(38)21-8-4-3-5-9-21)28(34)27-23(16-20-12-14-24(36-2)15-13-20)17-22-10-6-7-11-25(22)32(30(27)35)18-26(33)37-31/h3-15,19H,16-18,31H2,1-2H3