5-[(2S)-1-[[2-(2-methoxyphenyl)pyrimidin-5-yl]methyl]pyrrolidin-2-yl]thiophene-2-carboxamide

Systemtic Name: 5-[(2S)-1-[[2-(2-methoxyphenyl)pyrimidin-5-yl]methyl]pyrrolidin-2-yl]thiophene-2-carboxamide Openeye Name: 5-[(2S)-1-[[2-(2-methoxyphenyl)pyrimidin-5-yl]methyl]pyrrolidin-2-yl]thiophene-2-carboxamide CAS Name: 5-[(2S)-1-[[2-(2-methoxyphenyl)-5-pyrimidinyl]methyl]-2-pyrrolidinyl]-2-thiophenecarboxamide IUPAC Name: 5-[(2S)-1-[[2-(2-methoxyphenyl)pyrimidin-5-yl]methyl]pyrrolidin-2-yl]thiophene-2-carboxamide Traditional Name: 5-[(2S)-1-[[2-(2-methoxyphenyl)pyrimidin-5-yl]methyl]pyrrolidin-2-yl]thiophene-2-carboxamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC=C(C=N2)CN3CCCC3C4=CC=C(S4)C(=O)N

Isomeric SMILES

COC1=CC=CC=C1C2=NC=C(C=N2)CN3CCC[C@H]3C4=CC=C(S4)C(=O)N

InChI

InChI=1S/C21H22N4O2S/c1-27-17-7-3-2-5-15(17)21-23-11-14(12-24-21)13-25-10-4-6-16(25)18-8-9-19(28-18)20(22)26/h2-3,5,7-9,11-12,16H,4,6,10,13H2,1H3,(H2,22,26)/t16-/m0/s1