[2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethyl-thiophen-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethyl-thiophen-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethyl-3-thienyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [2-(2,5-dimethyl-1-pyrrolyl)-4,5-dimethyl-3-thiophenyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethylthiophen-3-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethyl-3-thienyl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C(=C(S2)C)C)C(=O)N3CCN(CC3)C4=NC=CC=N4)C

Isomeric SMILES

CC1=CC=C(N1C2=C(C(=C(S2)C)C)C(=O)N3CCN(CC3)C4=NC=CC=N4)C

InChI

InChI=1S/C21H25N5OS/c1-14-6-7-15(2)26(14)20-18(16(3)17(4)28-20)19(27)24-10-12-25(13-11-24)21-22-8-5-9-23-21/h5-9H,10-13H2,1-4H3