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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-4-(4-ketoquinazolin-3-yl)butyramide Formula: C27H24N4O2S MolecularWeight: 468.57006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCCN4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCCN4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C27H24N4O2S/c1-2-19-13-15-20(16-14-19)31(27-29-23-10-5-6-11-24(23)34-27)25(32)12-7-17-30-18-28-22-9-4-3-8-21(22)26(30)33/h3-6,8-11,13-16,18H,2,7,12,17H2,1H3