2-(azepan-1-yl)-N-[(3R)-2-methylidene-3-phenyl-1,3-dihydro-1,5-benzodiazepin-4-yl]ethanamide

Systemtic Name: 2-(azepan-1-yl)-N-[(3R)-2-methylidene-3-phenyl-1,3-dihydro-1,5-benzodiazepin-4-yl]ethanamide Openeye Name: 2-(azepan-1-yl)-N-[(3R)-2-methylene-3-phenyl-1,3-dihydro-1,5-benzodiazepin-4-yl]acetamide CAS Name: 2-(1-azepanyl)-N-[(3R)-2-methylene-3-phenyl-1,3-dihydro-1,5-benzodiazepin-4-yl]acetamide IUPAC Name: 2-(azepan-1-yl)-N-[(3R)-2-methylidene-3-phenyl-1,3-dihydro-1,5-benzodiazepin-4-yl]acetamide Traditional Name: 2-(azepan-1-yl)-N-[(3R)-2-methylene-3-phenyl-1,3-dihydro-1,5-benzodiazepin-4-yl]acetamide Formula: C24H28N4O MolecularWeight: 388.50532

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(=NC2=CC=CC=C2N1)NC(=O)CN3CCCCCC3)C4=CC=CC=C4

Isomeric SMILES

C=C1[C@H](C(=NC2=CC=CC=C2N1)NC(=O)CN3CCCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O/c1-18-23(19-11-5-4-6-12-19)24(26-21-14-8-7-13-20(21)25-18)27-22(29)17-28-15-9-2-3-10-16-28/h4-8,11-14,23,25H,1-3,9-10,15-17H2,(H,26,27,29)/t23-/m0/s1