2-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-ethynoxy-phenyl]-6-methyl-8-propyl-1H-imidazo[1,5-a][1,3,5]triazin-4-one

Systemtic Name: 2-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-ethynoxy-phenyl]-6-methyl-8-propyl-1H-imidazo[1,5-a][1,3,5]triazin-4-one Openeye Name: 2-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-ethynoxy-phenyl]-6-methyl-8-propyl-1H-imidazo[1,5-a][1,3,5]triazin-4-one CAS Name: 2-[5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-ethynoxyphenyl]-6-methyl-8-propyl-1H-imidazo[1,5-a][1,3,5]triazin-4-one IUPAC Name: 2-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-ethynoxyphenyl]-6-methyl-8-propyl-1H-imidazo[1,5-a][1,3,5]triazin-4-one Traditional Name: 2-[5-(4-ethylpiperazino)sulfonyl-2-ethynoxy-phenyl]-6-methyl-8-propyl-1H-imidazo[1,5-a][1,3,5]triazin-4-one Formula: C23H28N6O4S MolecularWeight: 484.57122

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2NC(=NC(=O)N2C(=N1)C)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CC)OC#C

Isomeric SMILES

CCCC1=C2NC(=NC(=O)N2C(=N1)C)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CC)OC#C

InChI

InChI=1S/C23H28N6O4S/c1-5-8-19-22-25-21(26-23(30)29(22)16(4)24-19)18-15-17(9-10-20(18)33-7-3)34(31,32)28-13-11-27(6-2)12-14-28/h3,9-10,15H,5-6,8,11-14H2,1-2,4H3,(H,25,26,30)