N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(4-oxidanylidenequinazolin-3-yl)-N-(phenylmethyl)butanamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(4-oxidanylidenequinazolin-3-yl)-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(4-oxo-3-quinazolinyl)-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-benzyl-4-(4-ketoquinazolin-3-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)butyramide Formula: C27H24N4O3S MolecularWeight: 484.56946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)CCCN4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)CCCN4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C27H24N4O3S/c1-34-20-13-14-23-24(16-20)35-27(29-23)31(17-19-8-3-2-4-9-19)25(32)12-7-15-30-18-28-22-11-6-5-10-21(22)26(30)33/h2-6,8-11,13-14,16,18H,7,12,15,17H2,1H3