[5-cyclopropyl-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]pyrazol-4-yl]-thiomorpholin-4-yl-methanone

Systemtic Name: [5-cyclopropyl-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]pyrazol-4-yl]-thiomorpholin-4-yl-methanone Openeye Name: [5-cyclopropyl-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]pyrazol-4-yl]-thiomorpholino-methanone CAS Name: [5-cyclopropyl-1-[4-(2-methoxyphenyl)-2-pyrimidinyl]-4-pyrazolyl]-thiomorpholin-4-ylmethanone IUPAC Name: [5-cyclopropyl-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]pyrazol-4-yl]-thiomorpholin-4-ylmethanone Traditional Name: [5-cyclopropyl-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]pyrazol-4-yl]-thiomorpholino-methanone Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)N4CCSCC4)C5CC5

Isomeric SMILES

COC1=CC=CC=C1C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)N4CCSCC4)C5CC5

InChI

InChI=1S/C22H23N5O2S/c1-29-19-5-3-2-4-16(19)18-8-9-23-22(25-18)27-20(15-6-7-15)17(14-24-27)21(28)26-10-12-30-13-11-26/h2-5,8-9,14-15H,6-7,10-13H2,1H3