[4-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[[1-(2-pyrimidinyl)-2-pyrrolyl]methyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[(1-pyrimidin-2-ylpyrrol-2-yl)methyl]piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[[1-(2-pyrimidyl)pyrrol-2-yl]methyl]piperazino]-(2-thienyl)methanone Formula: C18H19N5OS MolecularWeight: 353.44136

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CN2C3=NC=CC=N3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC2=CC=CN2C3=NC=CC=N3)C(=O)C4=CC=CS4

InChI

InChI=1S/C18H19N5OS/c24-17(16-5-2-13-25-16)22-11-9-21(10-12-22)14-15-4-1-8-23(15)18-19-6-3-7-20-18/h1-8,13H,9-12,14H2