3-(azepan-1-ylsulfonyl)-4-chloranyl-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-benzamide Formula: C23H25ClN4O4S MolecularWeight: 488.987

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H25ClN4O4S/c1-27(15-21-25-19-9-5-4-8-17(19)22(29)26-21)23(30)16-10-11-18(24)20(14-16)33(31,32)28-12-6-2-3-7-13-28/h4-5,8-11,14H,2-3,6-7,12-13,15H2,1H3,(H,25,26,29)