(2R)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-5-methyl-7-oxidanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-4-(oxan-4-ylamino)butan-1-one

Systemtic Name: (2R)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-5-methyl-7-oxidanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-4-(oxan-4-ylamino)butan-1-one Openeye Name: (2R)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-4-(tetrahydropyran-4-ylamino)butan-1-one CAS Name: (2R)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]-1-piperazinyl]-4-(4-oxanylamino)-1-butanone IUPAC Name: (2R)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-4-(oxan-4-ylamino)butan-1-one Traditional Name: (2R)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazino]-4-(tetrahydropyran-4-ylamino)butan-1-one Formula: C27H36ClN5O3 MolecularWeight: 514.05944

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C2=C1C(=NC=N2)N3CCN(CC3)C(=O)C(CCNC4CCOCC4)C5=CC=C(C=C5)Cl)O

Isomeric SMILES

C[C@@H]1C[C@H](C2=C1C(=NC=N2)N3CCN(CC3)C(=O)[C@H](CCNC4CCOCC4)C5=CC=C(C=C5)Cl)O

InChI

InChI=1S/C27H36ClN5O3/c1-18-16-23(34)25-24(18)26(31-17-30-25)32-10-12-33(13-11-32)27(35)22(19-2-4-20(28)5-3-19)6-9-29-21-7-14-36-15-8-21/h2-5,17-18,21-23,29,34H,6-16H2,1H3/t18-,22-,23-/m1/s1