N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(2-methyl-4-oxo-quinazolin-3-yl)butanamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(2-methyl-4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(2-methyl-4-oxoquinazolin-3-yl)butanamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(4-keto-2-methyl-quinazolin-3-yl)butyramide Formula: C22H22N4O3S MolecularWeight: 422.50008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCN3C(=NC4=CC=CC=C4C3=O)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCN3C(=NC4=CC=CC=C4C3=O)C

InChI

InChI=1S/C22H22N4O3S/c1-3-29-15-10-11-18-19(13-15)30-22(24-18)25-20(27)9-6-12-26-14(2)23-17-8-5-4-7-16(17)21(26)28/h4-5,7-8,10-11,13H,3,6,9,12H2,1-2H3,(H,24,25,27)