3-ethyl-7-[[(1S)-1-(4-methylphenyl)-2-morpholin-4-yl-ethyl]carbamoyl]-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-ethyl-7-[[(1S)-1-(4-methylphenyl)-2-morpholin-4-yl-ethyl]carbamoyl]-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-ethyl-7-[[(1S)-2-morpholino-1-(p-tolyl)ethyl]carbamoyl]-2-thioxo-quinazolin-4-olate CAS Name: 3-ethyl-7-[[[(1S)-1-(4-methylphenyl)-2-(4-morpholinyl)ethyl]amino]-oxomethyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-ethyl-7-[[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]carbamoyl]-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-ethyl-7-[[(1S)-2-morpholino-1-(p-tolyl)ethyl]carbamoyl]-2-thioxo-quinazolin-4-olate Formula: C24H27N4O3S- MolecularWeight: 451.56118

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C=CC(=CC2=NC1=S)C(=O)NC(CN3CCOCC3)C4=CC=C(C=C4)C)[O-]

Isomeric SMILES

CCN1C(=C2C=CC(=CC2=NC1=S)C(=O)N[C@H](CN3CCOCC3)C4=CC=C(C=C4)C)[O-]

InChI

InChI=1S/C24H28N4O3S/c1-3-28-23(30)19-9-8-18(14-20(19)26-24(28)32)22(29)25-21(15-27-10-12-31-13-11-27)17-6-4-16(2)5-7-17/h4-9,14,21,30H,3,10-13,15H2,1-2H3,(H,25,29)/p-1/t21-/m1/s1