7-[2-(phenethylamino)-1,3-thiazol-4-yl]-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 7-[2-(phenethylamino)-1,3-thiazol-4-yl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 7-[2-(phenethylamino)thiazol-4-yl]-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 7-[2-(phenethylamino)-4-thiazolyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 7-[2-(phenethylamino)-1,3-thiazol-4-yl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 7-[2-(phenethylamino)thiazol-4-yl]-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C3=CSC(=N3)NCCC4=CC=CC=C4)NC(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2)C3=CSC(=N3)NCCC4=CC=CC=C4)NC(=O)C1

InChI

InChI=1S/C21H21N3OS/c25-20-8-4-7-16-13-17(9-10-18(16)23-20)19-14-26-21(24-19)22-12-11-15-5-2-1-3-6-15/h1-3,5-6,9-10,13-14H,4,7-8,11-12H2,(H,22,24)(H,23,25)