2-(7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-[2-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]ethanamide

Systemtic Name: 2-(7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-[2-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]ethanamide Openeye Name: 2-[7-methyl-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-[2-(4-oxo-1H-quinazolin-2-yl)ethyl]acetamide CAS Name: 2-[7-methyl-2-(3-thiophenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-[2-(4-oxo-1H-quinazolin-2-yl)ethyl]acetamide IUPAC Name: 2-(7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-[2-(4-oxo-1H-quinazolin-2-yl)ethyl]acetamide Traditional Name: N-[2-(4-keto-1H-quinazolin-2-yl)ethyl]-2-[7-methyl-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide Formula: C26H26N4O3S MolecularWeight: 474.57464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(CN(C2)CC(=O)NCCC3=NC(=O)C4=CC=CC=C4N3)C5=CSC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)OC(CN(C2)CC(=O)NCCC3=NC(=O)C4=CC=CC=C4N3)C5=CSC=C5

InChI

InChI=1S/C26H26N4O3S/c1-17-6-7-22-19(12-17)13-30(14-23(33-22)18-9-11-34-16-18)15-25(31)27-10-8-24-28-21-5-3-2-4-20(21)26(32)29-24/h2-7,9,11-12,16,23H,8,10,13-15H2,1H3,(H,27,31)(H,28,29,32)