7-[[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-yl-ethyl]carbamoyl]-3-prop-2-enyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 7-[[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-yl-ethyl]carbamoyl]-3-prop-2-enyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-allyl-7-[[(2S)-2-(5-methyl-2-furyl)-2-morpholino-ethyl]carbamoyl]-2-thioxo-quinazolin-4-olate CAS Name: 7-[[[(2S)-2-(5-methyl-2-furanyl)-2-(4-morpholinyl)ethyl]amino]-oxomethyl]-3-prop-2-enyl-2-sulfanylidene-4-quinazolinolate IUPAC Name: 7-[[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]carbamoyl]-3-prop-2-enyl-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-allyl-7-[[(2S)-2-(5-methyl-2-furyl)-2-morpholino-ethyl]carbamoyl]-2-thioxo-quinazolin-4-olate Formula: C23H25N4O4S- MolecularWeight: 453.534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(CNC(=O)C2=CC3=NC(=S)N(C(=C3C=C2)[O-])CC=C)N4CCOCC4

Isomeric SMILES

CC1=CC=C(O1)[C@H](CNC(=O)C2=CC3=NC(=S)N(C(=C3C=C2)[O-])CC=C)N4CCOCC4

InChI

InChI=1S/C23H26N4O4S/c1-3-8-27-22(29)17-6-5-16(13-18(17)25-23(27)32)21(28)24-14-19(20-7-4-15(2)31-20)26-9-11-30-12-10-26/h3-7,13,19,29H,1,8-12,14H2,2H3,(H,24,28)/p-1/t19-/m0/s1