2-(azepan-1-yl)-N-(2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl)ethanamide

Systemtic Name: 2-(azepan-1-yl)-N-(2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl)ethanamide Openeye Name: 2-(azepan-1-yl)-N-[2-(3-pyridyl)-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide CAS Name: 2-(1-azepanyl)-N-[2-(3-pyridinyl)-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide IUPAC Name: 2-(azepan-1-yl)-N-(2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl)acetamide Traditional Name: 2-(azepan-1-yl)-N-[2-(3-pyridyl)-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC(=O)NC2CCCC3=NC(=NC=C23)C4=CN=CC=C4

Isomeric SMILES

C1CCCN(CC1)CC(=O)NC2CCCC3=NC(=NC=C23)C4=CN=CC=C4

InChI

InChI=1S/C21H27N5O/c27-20(15-26-11-3-1-2-4-12-26)24-18-8-5-9-19-17(18)14-23-21(25-19)16-7-6-10-22-13-16/h6-7,10,13-14,18H,1-5,8-9,11-12,15H2,(H,24,27)