tert-butyl (3S)-3-[[6-(2-methylphenyl)-7-oxidanylidene-8-(oxolan-3-yl)pyrido[2,3-d]pyrimidin-2-yl]amino]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (3S)-3-[[6-(2-methylphenyl)-7-oxidanylidene-8-(oxolan-3-yl)pyrido[2,3-d]pyrimidin-2-yl]amino]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (3S)-3-[[6-(o-tolyl)-7-oxo-8-tetrahydrofuran-3-yl-pyrido[2,3-d]pyrimidin-2-yl]amino]pyrrolidine-1-carboxylate CAS Name: (3S)-3-[[6-(2-methylphenyl)-7-oxo-8-(3-oxolanyl)-2-pyrido[2,3-d]pyrimidinyl]amino]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-3-[[6-(2-methylphenyl)-7-oxo-8-(oxolan-3-yl)pyrido[2,3-d]pyrimidin-2-yl]amino]pyrrolidine-1-carboxylate Traditional Name: (3S)-3-[[7-keto-6-(o-tolyl)-8-tetrahydrofuran-3-yl-pyrido[2,3-d]pyrimidin-2-yl]amino]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C27H33N5O4 MolecularWeight: 491.58202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=CN=C(N=C3N(C2=O)C4CCOC4)NC5CCN(C5)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=CN=C(N=C3N(C2=O)C4CCOC4)N[C@H]5CCN(C5)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H33N5O4/c1-17-7-5-6-8-21(17)22-13-18-14-28-25(30-23(18)32(24(22)33)20-10-12-35-16-20)29-19-9-11-31(15-19)26(34)36-27(2,3)4/h5-8,13-14,19-20H,9-12,15-16H2,1-4H3,(H,28,29,30)/t19-,20?/m0/s1