1-[2-[[4-(phenylcarbonyl)-1,4-diazepan-1-yl]methyl]morpholin-4-yl]-2-thiophen-2-yl-ethanone

Systemtic Name: 1-[2-[[4-(phenylcarbonyl)-1,4-diazepan-1-yl]methyl]morpholin-4-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[2-[(4-benzoyl-1,4-diazepan-1-yl)methyl]morpholin-4-yl]-2-(2-thienyl)ethanone CAS Name: 1-[2-[(4-benzoyl-1,4-diazepan-1-yl)methyl]-4-morpholinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[2-[(4-benzoyl-1,4-diazepan-1-yl)methyl]morpholin-4-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[2-[(4-benzoyl-1,4-diazepan-1-yl)methyl]morpholino]-2-(2-thienyl)ethanone Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC=CC=C2)CC3CN(CCO3)C(=O)CC4=CC=CS4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC=CC=C2)CC3CN(CCO3)C(=O)CC4=CC=CS4

InChI

InChI=1S/C23H29N3O3S/c27-22(16-21-8-4-15-30-21)26-13-14-29-20(18-26)17-24-9-5-10-25(12-11-24)23(28)19-6-2-1-3-7-19/h1-4,6-8,15,20H,5,9-14,16-18H2