4-[(2R)-2-azanyl-3-[4-[(5R,7R)-5-methyl-7-oxidanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-3-oxidanylidene-propyl]benzenecarbonitrile

Systemtic Name: 4-[(2R)-2-azanyl-3-[4-[(5R,7R)-5-methyl-7-oxidanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-3-oxidanylidene-propyl]benzenecarbonitrile Openeye Name: 4-[(2R)-2-amino-3-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-3-oxo-propyl]benzonitrile CAS Name: 4-[(2R)-2-amino-3-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]-1-piperazinyl]-3-oxopropyl]benzonitrile IUPAC Name: 4-[(2R)-2-amino-3-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-3-oxopropyl]benzonitrile Traditional Name: 4-[(2R)-2-amino-3-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazino]-3-keto-propyl]benzonitrile Formula: C22H26N6O2 MolecularWeight: 406.48084

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C2=C1C(=NC=N2)N3CCN(CC3)C(=O)C(CC4=CC=C(C=C4)C#N)N)O

Isomeric SMILES

C[C@@H]1C[C@H](C2=C1C(=NC=N2)N3CCN(CC3)C(=O)[C@@H](CC4=CC=C(C=C4)C#N)N)O

InChI

InChI=1S/C22H26N6O2/c1-14-10-18(29)20-19(14)21(26-13-25-20)27-6-8-28(9-7-27)22(30)17(24)11-15-2-4-16(12-23)5-3-15/h2-5,13-14,17-18,29H,6-11,24H2,1H3/t14-,17-,18-/m1/s1