3-(1,3-benzothiazol-2-yl)-N-[2-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]propanamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]propanamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]propanamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]propanamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]propionamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2CN1CCNC(=O)CCC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

Isomeric SMILES

C1C(OC2=CC=CC=C2CN1CCNC(=O)CCC3=NC4=CC=CC=C4S3)C5=CC=CC=C5

InChI

InChI=1S/C27H27N3O2S/c31-26(14-15-27-29-22-11-5-7-13-25(22)33-27)28-16-17-30-18-21-10-4-6-12-23(21)32-24(19-30)20-8-2-1-3-9-20/h1-13,24H,14-19H2,(H,28,31)