(4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (4,5-dimethyl-2-pyrrol-1-yl-thiophen-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [4,5-dimethyl-2-(1-pyrrolyl)-3-thiophenyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (4,5-dimethyl-2-pyrrol-1-ylthiophen-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (4,5-dimethyl-2-pyrrol-1-yl-3-thienyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N2CCN(CC2)C3=NC=CC=N3)N4C=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N2CCN(CC2)C3=NC=CC=N3)N4C=CC=C4)C

InChI

InChI=1S/C19H21N5OS/c1-14-15(2)26-18(23-8-3-4-9-23)16(14)17(25)22-10-12-24(13-11-22)19-20-6-5-7-21-19/h3-9H,10-13H2,1-2H3