3-cyclopentyl-N-(12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)propanamide

Systemtic Name: 3-cyclopentyl-N-(12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)propanamide Openeye Name: 3-cyclopentyl-N-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)propanamide CAS Name: 3-cyclopentyl-N-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)propanamide IUPAC Name: 3-cyclopentyl-N-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)propanamide Traditional Name: 3-cyclopentyl-N-(12-keto-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)propionamide Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=C(C=C(C=C3)NC(=O)CCC4CCCC4)C(=O)N2CC1

Isomeric SMILES

C1CCC2=NC3=C(C=C(C=C3)NC(=O)CCC4CCCC4)C(=O)N2CC1

InChI

InChI=1S/C21H27N3O2/c25-20(12-9-15-6-3-4-7-15)22-16-10-11-18-17(14-16)21(26)24-13-5-1-2-8-19(24)23-18/h10-11,14-15H,1-9,12-13H2,(H,22,25)