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1-(azepan-1-yl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-ethanone

1-(azepan-1-yl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-ethanone

Systemtic Name:1-(azepan-1-yl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-ethanone
Openeye Name:1-(azepan-1-yl)-2-[2-(2-thienyl)quinazolin-4-yl]sulfanyl-ethanone
CAS Name:1-(1-azepanyl)-2-[(2-thiophen-2-yl-4-quinazolinyl)thio]ethanone
IUPAC Name:1-(azepan-1-yl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylethanone
Traditional Name:1-(azepan-1-yl)-2-[[2-(2-thienyl)quinazolin-4-yl]thio]ethanone
Formula: C20H21N3OS2
MolecularWeight: 383.53024
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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CS4


Isomeric SMILES

C1CCCN(CC1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CS4


InChI

InChI=1S/C20H21N3OS2/c24-18(23-11-5-1-2-6-12-23)14-26-20-15-8-3-4-9-16(15)21-19(22-20)17-10-7-13-25-17/h3-4,7-10,13H,1-2,5-6,11-12,14H2


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