N-(2-methoxyethyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azepane-1-sulfonamide

Systemtic Name: N-(2-methoxyethyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]azepane-1-sulfonamide Openeye Name: N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]azepane-1-sulfonamide CAS Name: N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-azepanesulfonamide IUPAC Name: N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]azepane-1-sulfonamide Traditional Name: N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-(2-methoxyethyl)azepane-1-sulfonamide Formula: C18H26N4O4S MolecularWeight: 394.48844

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C18H26N4O4S/c1-26-13-12-22(27(24,25)21-10-6-2-3-7-11-21)14-17-19-16-9-5-4-8-15(16)18(23)20-17/h4-5,8-9H,2-3,6-7,10-14H2,1H3,(H,19,20,23)