3-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-[methyl-[(3-methyl-2-thienyl)methyl]amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-[methyl-[(3-methyl-2-thiophenyl)methyl]amino]-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-[methyl-[(3-methyl-2-thienyl)methyl]amino]-1-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C18H25N5OS MolecularWeight: 359.489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(C)CCC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC1=C(SC=C1)CN(C)CCC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C18H25N5OS/c1-15-5-13-25-16(15)14-21(2)8-4-17(24)22-9-11-23(12-10-22)18-19-6-3-7-20-18/h3,5-7,13H,4,8-12,14H2,1-2H3