4-[(6-morpholin-4-yl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-phenethyl-benzamide

Systemtic Name: 4-[(6-morpholin-4-yl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-phenethyl-benzamide Openeye Name: 4-[(6-morpholino-4-oxo-2-thioxo-1H-quinazolin-3-yl)methyl]-N-phenethyl-benzamide CAS Name: 4-[[6-(4-morpholinyl)-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl]methyl]-N-phenethylbenzamide IUPAC Name: 4-[(6-morpholin-4-yl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-phenethylbenzamide Traditional Name: 4-[(4-keto-6-morpholino-2-thioxo-1H-quinazolin-3-yl)methyl]-N-phenethyl-benzamide Formula: C28H28N4O3S MolecularWeight: 500.61192

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)NC(=S)N(C3=O)CC4=CC=C(C=C4)C(=O)NCCC5=CC=CC=C5

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)NC(=S)N(C3=O)CC4=CC=C(C=C4)C(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C28H28N4O3S/c33-26(29-13-12-20-4-2-1-3-5-20)22-8-6-21(7-9-22)19-32-27(34)24-18-23(31-14-16-35-17-15-31)10-11-25(24)30-28(32)36/h1-11,18H,12-17,19H2,(H,29,33)(H,30,36)