(2R)-2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: (2R)-2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: (2R)-2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: (2R)-2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: (2R)-2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: (2R)-2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-1-(4-phenylpiperazino)propan-1-one Formula: C18H23N5OS MolecularWeight: 357.47312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(C)C(=O)N2CCN(CC2)C3=CC=CC=C3)N

Isomeric SMILES

CC1=CC(=NC(=N1)S[C@H](C)C(=O)N2CCN(CC2)C3=CC=CC=C3)N

InChI

InChI=1S/C18H23N5OS/c1-13-12-16(19)21-18(20-13)25-14(2)17(24)23-10-8-22(9-11-23)15-6-4-3-5-7-15/h3-7,12,14H,8-11H2,1-2H3,(H2,19,20,21)/t14-/m1/s1