3-(1,3-benzothiazol-2-yl)-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]pyrazine-2-carboxamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]pyrazine-2-carboxamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]pyrazine-2-carboxamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-2-pyrazinecarboxamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]pyrazine-2-carboxamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-pyrazinamide Formula: C22H16N6O2S MolecularWeight: 428.46644

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=NC=CN=C3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H16N6O2S/c1-28(12-17-25-14-7-3-2-6-13(14)20(29)27-17)22(30)19-18(23-10-11-24-19)21-26-15-8-4-5-9-16(15)31-21/h2-11H,12H2,1H3,(H,25,27,29)