N-[3-[8-(4-methylphenyl)carbonylimidazo[1,5-a]pyrimidin-4-yl]phenyl]-N-prop-2-ynyl-ethanesulfonamide

Systemtic Name: N-[3-[8-(4-methylphenyl)carbonylimidazo[1,5-a]pyrimidin-4-yl]phenyl]-N-prop-2-ynyl-ethanesulfonamide Openeye Name: N-[3-[8-(4-methylbenzoyl)imidazo[1,5-a]pyrimidin-4-yl]phenyl]-N-prop-2-ynyl-ethanesulfonamide CAS Name: N-[3-[8-[(4-methylphenyl)-oxomethyl]-4-imidazo[1,5-a]pyrimidinyl]phenyl]-N-prop-2-ynylethanesulfonamide IUPAC Name: N-[3-[8-(4-methylbenzoyl)imidazo[1,5-a]pyrimidin-4-yl]phenyl]-N-prop-2-ynylethanesulfonamide Traditional Name: N-propargyl-N-[3-(8-p-toluoylimidazo[1,5-a]pyrimidin-4-yl)phenyl]ethanesulfonamide Formula: C25H22N4O3S MolecularWeight: 458.53218

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(CC#C)C1=CC=CC(=C1)C2=CC=NC3=C(N=CN23)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCS(=O)(=O)N(CC#C)C1=CC=CC(=C1)C2=CC=NC3=C(N=CN23)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H22N4O3S/c1-4-15-29(33(31,32)5-2)21-8-6-7-20(16-21)22-13-14-26-25-23(27-17-28(22)25)24(30)19-11-9-18(3)10-12-19/h1,6-14,16-17H,5,15H2,2-3H3