N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-(4-keto-1H-quinazolin-2-yl)propionamide Formula: C21H16N4O4S MolecularWeight: 420.44114

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)CCC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)CCC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C21H16N4O4S/c26-19(8-7-18-22-14-4-2-1-3-13(14)20(27)24-18)25-21-23-15(10-30-21)12-5-6-16-17(9-12)29-11-28-16/h1-6,9-10H,7-8,11H2,(H,22,24,27)(H,23,25,26)