N-[3-[1-[3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoylamino]ethyl]phenyl]benzamide

Systemtic Name: N-[3-[1-[3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoylamino]ethyl]phenyl]benzamide Openeye Name: N-[3-[1-[3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanoylamino]ethyl]phenyl]benzamide CAS Name: N-[3-[1-[[1-oxo-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propyl]amino]ethyl]phenyl]benzamide IUPAC Name: N-[3-[1-[3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanoylamino]ethyl]phenyl]benzamide Traditional Name: N-[3-[1-[3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propanoylamino]ethyl]phenyl]benzamide Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

CC(C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C26H24N4O3S/c1-17(19-10-7-11-20(16-19)28-24(32)18-8-3-2-4-9-18)27-23(31)14-15-30-25(33)21-12-5-6-13-22(21)29-26(30)34/h2-13,16-17H,14-15H2,1H3,(H,27,31)(H,28,32)(H,29,34)