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

Systemtic Name: N-[3-[ethyl(phenyl)amino]propyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Openeye Name: N-[3-(N-ethylanilino)propyl]-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: N-[3-(N-ethylanilino)propyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide IUPAC Name: N-[3-(N-ethylanilino)propyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Traditional Name: N-[3-(N-ethylanilino)propyl]-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanamide Formula: C25H32N4O2S MolecularWeight: 452.61218

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)CCCCCN1C(=O)C2=CC=CC=C2NC1=S)C3=CC=CC=C3

Isomeric SMILES

CCN(CCCNC(=O)CCCCCN1C(=O)C2=CC=CC=C2NC1=S)C3=CC=CC=C3

InChI

InChI=1S/C25H32N4O2S/c1-2-28(20-12-5-3-6-13-20)18-11-17-26-23(30)16-7-4-10-19-29-24(31)21-14-8-9-15-22(21)27-25(29)32/h3,5-6,8-9,12-15H,2,4,7,10-11,16-19H2,1H3,(H,26,30)(H,27,32)