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

Systemtic Name: N-[2-(diethylamino)-3-phenyl-propyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Openeye Name: N-[2-(diethylamino)-3-phenyl-propyl]-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: N-[2-(diethylamino)-3-phenylpropyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide IUPAC Name: N-[2-(diethylamino)-3-phenylpropyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Traditional Name: N-[2-(diethylamino)-3-phenyl-propyl]-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanamide Formula: C27H36N4O2S MolecularWeight: 480.66534

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CC1=CC=CC=C1)CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CCN(CC)C(CC1=CC=CC=C1)CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C27H36N4O2S/c1-3-30(4-2)22(19-21-13-7-5-8-14-21)20-28-25(32)17-9-6-12-18-31-26(33)23-15-10-11-16-24(23)29-27(31)34/h5,7-8,10-11,13-16,22H,3-4,6,9,12,17-20H2,1-2H3,(H,28,32)(H,29,34)