N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(4-oxo-1H-quinazolin-2-yl)butanamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(4-oxo-1H-quinazolin-2-yl)butanamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(4-oxo-1H-quinazolin-2-yl)butanamide Traditional Name: 4-(4-keto-1H-quinazolin-2-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)butyramide Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C20H18N4O3S/c1-27-12-9-10-15-16(11-12)28-20(22-15)24-18(25)8-4-7-17-21-14-6-3-2-5-13(14)19(26)23-17/h2-3,5-6,9-11H,4,7-8H2,1H3,(H,21,23,26)(H,22,24,25)