2-[3-[(3,4-dimethyl-2-sulfanylidene-pentanoyl)amino]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid

Systemtic Name: 2-[3-[(3,4-dimethyl-2-sulfanylidene-pentanoyl)amino]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid Openeye Name: 2-[3-[(3,4-dimethyl-2-thioxo-pentanoyl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid CAS Name: 2-[3-[(3,4-dimethyl-1-oxo-2-sulfanylidenepentyl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid IUPAC Name: 2-[3-[(3,4-dimethyl-2-sulfanylidenepentanoyl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Traditional Name: 2-[3-[(3,4-dimethyl-2-thioxo-pentanoyl)amino]-2-keto-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid Formula: C19H24N2O4S MolecularWeight: 376.46986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)C(=S)C(=O)NC1CCC2=CC=CC=C2N(C1=O)CC(=O)O

Isomeric SMILES

CC(C)C(C)C(=S)C(=O)NC1CCC2=CC=CC=C2N(C1=O)CC(=O)O

InChI

InChI=1S/C19H24N2O4S/c1-11(2)12(3)17(26)18(24)20-14-9-8-13-6-4-5-7-15(13)21(19(14)25)10-16(22)23/h4-7,11-12,14H,8-10H2,1-3H3,(H,20,24)(H,22,23)