3-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-3-yl)sulfanyl]-N-(1,3-thiazol-2-yl)propanamide

Systemtic Name: 3-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-3-yl)sulfanyl]-N-(1,3-thiazol-2-yl)propanamide Openeye Name: 3-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-3-yl)sulfanyl]-N-thiazol-2-yl-propanamide CAS Name: 3-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-3-yl)thio]-N-(2-thiazolyl)propanamide IUPAC Name: 3-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-3-yl)sulfanyl]-N-(1,3-thiazol-2-yl)propanamide Traditional Name: 3-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-3-yl)thio]-N-thiazol-2-yl-propionamide Formula: C16H17N3O2S2 MolecularWeight: 347.45508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2NC(=O)C1SCCC(=O)NC3=NC=CS3

Isomeric SMILES

C1CC2=CC=CC=C2NC(=O)C1SCCC(=O)NC3=NC=CS3

InChI

InChI=1S/C16H17N3O2S2/c20-14(19-16-17-8-10-23-16)7-9-22-13-6-5-11-3-1-2-4-12(11)18-15(13)21/h1-4,8,10,13H,5-7,9H2,(H,18,21)(H,17,19,20)