[8-butyl-3-(phenylsulfanylmethyl)-8H-imidazo[1,5-a]pyrazin-7-yl]-phenyl-methanone

Systemtic Name: [8-butyl-3-(phenylsulfanylmethyl)-8H-imidazo[1,5-a]pyrazin-7-yl]-phenyl-methanone Openeye Name: [8-butyl-3-(phenylsulfanylmethyl)-8H-imidazo[1,5-a]pyrazin-7-yl]-phenyl-methanone CAS Name: [8-butyl-3-[(phenylthio)methyl]-8H-imidazo[1,5-a]pyrazin-7-yl]-phenylmethanone IUPAC Name: [8-butyl-3-(phenylsulfanylmethyl)-8H-imidazo[1,5-a]pyrazin-7-yl]-phenylmethanone Traditional Name: [8-butyl-3-[(phenylthio)methyl]-8H-imidazo[1,5-a]pyrazin-7-yl]-phenyl-methanone Formula: C24H25N3OS MolecularWeight: 403.5398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C2=CN=C(N2C=CN1C(=O)C3=CC=CC=C3)CSC4=CC=CC=C4

Isomeric SMILES

CCCCC1C2=CN=C(N2C=CN1C(=O)C3=CC=CC=C3)CSC4=CC=CC=C4

InChI

InChI=1S/C24H25N3OS/c1-2-3-14-21-22-17-25-23(18-29-20-12-8-5-9-13-20)26(22)15-16-27(21)24(28)19-10-6-4-7-11-19/h4-13,15-17,21H,2-3,14,18H2,1H3