N-[4-(2-methylpropanoylamino)phenyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide

Systemtic Name: N-[4-(2-methylpropanoylamino)phenyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Openeye Name: N-[4-(2-methylpropanoylamino)phenyl]-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide IUPAC Name: N-[4-(2-methylpropanoylamino)phenyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Traditional Name: N-[4-(isobutyrylamino)phenyl]-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanamide Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C24H28N4O3S/c1-16(2)22(30)26-18-13-11-17(12-14-18)25-21(29)10-4-3-7-15-28-23(31)19-8-5-6-9-20(19)27-24(28)32/h5-6,8-9,11-14,16H,3-4,7,10,15H2,1-2H3,(H,25,29)(H,26,30)(H,27,32)