2-methyl-3-(oxidanylidenemethylidene)-4-[(2Z)-2-[2-oxidanylidene-2-(4-piperidin-1-ylpiperidin-1-yl)ethylidene]-4,5-dihydro-3H-1-benzazepin-1-yl]-N-phenyl-cyclohexa-1,5-diene-1-carboxamide

Systemtic Name: 2-methyl-3-(oxidanylidenemethylidene)-4-[(2Z)-2-[2-oxidanylidene-2-(4-piperidin-1-ylpiperidin-1-yl)ethylidene]-4,5-dihydro-3H-1-benzazepin-1-yl]-N-phenyl-cyclohexa-1,5-diene-1-carboxamide Openeye Name: 2-methyl-3-(oxomethylene)-4-[(2Z)-2-[2-oxo-2-[4-(1-piperidyl)-1-piperidyl]ethylidene]-4,5-dihydro-3H-1-benzazepin-1-yl]-N-phenyl-cyclohexa-1,5-diene-1-carboxamide CAS Name: 2-methyl-3-(oxomethylidene)-4-[(2Z)-2-[2-oxo-2-[4-(1-piperidinyl)-1-piperidinyl]ethylidene]-4,5-dihydro-3H-1-benzazepin-1-yl]-N-phenyl-1-cyclohexa-1,5-dienecarboxamide IUPAC Name: 2-methyl-3-(oxomethylidene)-4-[(2Z)-2-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethylidene]-4,5-dihydro-3H-1-benzazepin-1-yl]-N-phenylcyclohexa-1,5-diene-1-carboxamide Traditional Name: 3-(ketomethylene)-4-[(2Z)-2-[2-keto-2-(4-piperidinopiperidino)ethylidene]-4,5-dihydro-3H-1-benzazepin-1-yl]-2-methyl-N-phenyl-cyclohexa-1,5-diene-1-carboxamide Formula: C37H42N4O3 MolecularWeight: 590.75438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(C1=C=O)N2C(=CC(=O)N3CCC(CC3)N4CCCCC4)CCCC5=CC=CC=C52)C(=O)NC6=CC=CC=C6

Isomeric SMILES

CC1=C(C=CC(C1=C=O)N2/C(=C\C(=O)N3CCC(CC3)N4CCCCC4)/CCCC5=CC=CC=C52)C(=O)NC6=CC=CC=C6

InChI

InChI=1S/C37H42N4O3/c1-27-32(37(44)38-29-13-4-2-5-14-29)17-18-35(33(27)26-42)41-31(15-10-12-28-11-6-7-16-34(28)41)25-36(43)40-23-19-30(20-24-40)39-21-8-3-9-22-39/h2,4-7,11,13-14,16-18,25,30,35H,3,8-10,12,15,19-24H2,1H3,(H,38,44)/b31-25-