(2R)-2-[4-azanyl-3-methyl-2,6-bis(oxidanylidene)-5-piperidin-1-yl-pyrimidin-1-yl]-N-(2-phenylsulfanylphenyl)propanamide

Systemtic Name: (2R)-2-[4-azanyl-3-methyl-2,6-bis(oxidanylidene)-5-piperidin-1-yl-pyrimidin-1-yl]-N-(2-phenylsulfanylphenyl)propanamide Openeye Name: (2R)-2-[4-amino-3-methyl-2,6-dioxo-5-(1-piperidyl)pyrimidin-1-yl]-N-(2-phenylsulfanylphenyl)propanamide CAS Name: (2R)-2-[4-amino-3-methyl-2,6-dioxo-5-(1-piperidinyl)-1-pyrimidinyl]-N-[2-(phenylthio)phenyl]propanamide IUPAC Name: (2R)-2-(4-amino-3-methyl-2,6-dioxo-5-piperidin-1-ylpyrimidin-1-yl)-N-(2-phenylsulfanylphenyl)propanamide Traditional Name: (2R)-2-(4-amino-2,6-diketo-3-methyl-5-piperidino-pyrimidin-1-yl)-N-[2-(phenylthio)phenyl]propionamide Formula: C25H29N5O3S MolecularWeight: 479.59446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)N3C(=O)C(=C(N(C3=O)C)N)N4CCCCC4

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)N3C(=O)C(=C(N(C3=O)C)N)N4CCCCC4

InChI

InChI=1S/C25H29N5O3S/c1-17(23(31)27-19-13-7-8-14-20(19)34-18-11-5-3-6-12-18)30-24(32)21(22(26)28(2)25(30)33)29-15-9-4-10-16-29/h3,5-8,11-14,17H,4,9-10,15-16,26H2,1-2H3,(H,27,31)/t17-/m1/s1