N-[2,6-bis[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]-3-methoxy-benzamide

Systemtic Name: N-[2,6-bis[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]-3-methoxy-benzamide Openeye Name: N-[2,6-bis[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]-3-methoxy-benzamide CAS Name: N-[2,6-bis[(3S)-3-methyl-4-morpholinyl]-4-pyrimidinyl]-3-methoxybenzamide IUPAC Name: N-[2,6-bis[(3S)-3-methylmorpholin-4-yl]pyrimidin-4-yl]-3-methoxybenzamide Traditional Name: N-[2,6-bis[(3S)-3-methylmorpholino]pyrimidin-4-yl]-3-methoxy-benzamide Formula: C22H29N5O4 MolecularWeight: 427.49676

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Descriptors Computed from Structure

Canonical SMILES:

CC1COCCN1C2=CC(=NC(=N2)N3CCOCC3C)NC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

C[C@H]1COCCN1C2=CC(=NC(=N2)N3CCOC[C@@H]3C)NC(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C22H29N5O4/c1-15-13-30-9-7-26(15)20-12-19(23-21(28)17-5-4-6-18(11-17)29-3)24-22(25-20)27-8-10-31-14-16(27)2/h4-6,11-12,15-16H,7-10,13-14H2,1-3H3,(H,23,24,25,28)/t15-,16-/m0/s1