methyl 3-[2-[(2R)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[2-[(2R)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]propanoate Openeye Name: methyl 3-[2-[(1R)-2-(2-furylmethylamino)-1-methyl-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]propanoate CAS Name: 3-[2-[[(2R)-1-(2-furanylmethylamino)-1-oxopropan-2-yl]thio]-4-oxo-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[(2R)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]sulfanyl-4-oxoquinazolin-3-yl]propanoate Traditional Name: 3-[2-[[(1R)-2-(2-furfurylamino)-2-keto-1-methyl-ethyl]thio]-4-keto-quinazolin-3-yl]propionic acid methyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)SC2=NC3=CC=CC=C3C(=O)N2CCC(=O)OC

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CO1)SC2=NC3=CC=CC=C3C(=O)N2CCC(=O)OC

InChI

InChI=1S/C20H21N3O5S/c1-13(18(25)21-12-14-6-5-11-28-14)29-20-22-16-8-4-3-7-15(16)19(26)23(20)10-9-17(24)27-2/h3-8,11,13H,9-10,12H2,1-2H3,(H,21,25)/t13-/m1/s1