ethyl 4-[2-[3-[(2R)-1-methoxypropan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[2-[3-[(2R)-1-methoxypropan-2-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-[3-[(1R)-2-methoxy-1-methyl-ethyl]-4-oxo-quinazolin-2-yl]sulfanylacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-[[3-[(2R)-1-methoxypropan-2-yl]-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-[(2R)-1-methoxypropan-2-yl]-4-oxoquinazolin-2-yl]sulfanylacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-[[4-keto-3-[(1R)-2-methoxy-1-methyl-ethyl]quinazolin-2-yl]thio]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C(C)COC)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2[C@H](C)COC)C)C

InChI

InChI=1S/C23H27N3O5S/c1-6-31-22(29)20-15(4)24-14(3)19(20)18(27)12-32-23-25-17-10-8-7-9-16(17)21(28)26(23)13(2)11-30-5/h7-10,13,24H,6,11-12H2,1-5H3/t13-/m1/s1