methyl (4S)-6-(2,3-dihydroindol-1-ylmethyl)-4-(4-methoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4S)-6-(2,3-dihydroindol-1-ylmethyl)-4-(4-methoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-6-(indolin-1-ylmethyl)-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-(2,3-dihydroindol-1-ylmethyl)-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-6-(2,3-dihydroindol-1-ylmethyl)-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-(indolin-1-ylmethyl)-2-keto-4-(4-methoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2C(=C(NC(=O)N2)CN3CCC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C22H23N3O4/c1-28-16-9-7-15(8-10-16)20-19(21(26)29-2)17(23-22(27)24-20)13-25-12-11-14-5-3-4-6-18(14)25/h3-10,20H,11-13H2,1-2H3,(H2,23,24,27)/t20-/m0/s1