1-(azepan-1-yl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanyl-ethanone Openeye Name: 1-(azepan-1-yl)-2-(3-morpholinoquinoxalin-2-yl)sulfanyl-ethanone CAS Name: 1-(1-azepanyl)-2-[[3-(4-morpholinyl)-2-quinoxalinyl]thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylethanone Traditional Name: 1-(azepan-1-yl)-2-[(3-morpholinoquinoxalin-2-yl)thio]ethanone Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSC2=NC3=CC=CC=C3N=C2N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)C(=O)CSC2=NC3=CC=CC=C3N=C2N4CCOCC4

InChI

InChI=1S/C20H26N4O2S/c25-18(23-9-5-1-2-6-10-23)15-27-20-19(24-11-13-26-14-12-24)21-16-7-3-4-8-17(16)22-20/h3-4,7-8H,1-2,5-6,9-15H2