2,3,4,5-tetrahydro-1-benzazepin-1-yl-[4-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]methanone

Systemtic Name: 2,3,4,5-tetrahydro-1-benzazepin-1-yl-[4-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]methanone Openeye Name: 2,3,4,5-tetrahydro-1-benzazepin-1-yl-[4-(thiazol-4-ylmethylsulfanyl)phenyl]methanone CAS Name: 2,3,4,5-tetrahydro-1-benzazepin-1-yl-[4-(4-thiazolylmethylthio)phenyl]methanone IUPAC Name: 2,3,4,5-tetrahydro-1-benzazepin-1-yl-[4-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]methanone Traditional Name: 2,3,4,5-tetrahydro-1-benzazepin-1-yl-[4-(thiazol-4-ylmethylthio)phenyl]methanone Formula: C21H20N2OS2 MolecularWeight: 380.5263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C2=CC=CC=C2C1)C(=O)C3=CC=C(C=C3)SCC4=CSC=N4

Isomeric SMILES

C1CCN(C2=CC=CC=C2C1)C(=O)C3=CC=C(C=C3)SCC4=CSC=N4

InChI

InChI=1S/C21H20N2OS2/c24-21(23-12-4-3-6-16-5-1-2-7-20(16)23)17-8-10-19(11-9-17)26-14-18-13-25-15-22-18/h1-2,5,7-11,13,15H,3-4,6,12,14H2