N-(1,3-benzothiazol-2-yl)-4-[(4-oxidanylidenequinazolin-3-yl)methyl]cyclohexane-1-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-[(4-oxidanylidenequinazolin-3-yl)methyl]cyclohexane-1-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-[(4-oxoquinazolin-3-yl)methyl]cyclohexanecarboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-[(4-oxo-3-quinazolinyl)methyl]-1-cyclohexanecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-[(4-oxoquinazolin-3-yl)methyl]cyclohexane-1-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-[(4-ketoquinazolin-3-yl)methyl]cyclohexanecarboxamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN2C=NC3=CC=CC=C3C2=O)C(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(CCC1CN2C=NC3=CC=CC=C3C2=O)C(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H22N4O2S/c28-21(26-23-25-19-7-3-4-8-20(19)30-23)16-11-9-15(10-12-16)13-27-14-24-18-6-2-1-5-17(18)22(27)29/h1-8,14-16H,9-13H2,(H,25,26,28)