N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-(4-oxidanylidenequinazolin-3-yl)propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-(4-oxidanylidenequinazolin-3-yl)propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-(4-oxoquinazolin-3-yl)propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-(4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-(4-oxoquinazolin-3-yl)propanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-3-(4-ketoquinazolin-3-yl)propionamide Formula: C26H22N4O2S MolecularWeight: 454.54348

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCN4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCN4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C26H22N4O2S/c1-2-18-11-13-19(14-12-18)30(26-28-22-9-5-6-10-23(22)33-26)24(31)15-16-29-17-27-21-8-4-3-7-20(21)25(29)32/h3-14,17H,2,15-16H2,1H3