4-oxidanylidene-N-[2-[(2S)-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]chromene-2-carboxamide

Systemtic Name: 4-oxidanylidene-N-[2-[(2S)-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]chromene-2-carboxamide Openeye Name: 4-oxo-N-[2-[(2S)-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]chromene-2-carboxamide CAS Name: 4-oxo-N-[2-[(2S)-2-(3-thiophenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-1-benzopyran-2-carboxamide IUPAC Name: 4-oxo-N-[2-[(2S)-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]chromene-2-carboxamide Traditional Name: 4-keto-N-[2-[(2S)-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]chromene-2-carboxamide Formula: C25H22N2O4S MolecularWeight: 446.51818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2CN1CCNC(=O)C3=CC(=O)C4=CC=CC=C4O3)C5=CSC=C5

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2CN1CCNC(=O)C3=CC(=O)C4=CC=CC=C4O3)C5=CSC=C5

InChI

InChI=1S/C25H22N2O4S/c28-20-13-23(31-22-8-4-2-6-19(20)22)25(29)26-10-11-27-14-17-5-1-3-7-21(17)30-24(15-27)18-9-12-32-16-18/h1-9,12-13,16,24H,10-11,14-15H2,(H,26,29)/t24-/m1/s1