ethyl N'-(6-methyl-8-oxidanylidene-7H-imidazo[1,5-a]pyrazin-1-yl)-N-phenyl-carbamimidothioate

Systemtic Name: ethyl N'-(6-methyl-8-oxidanylidene-7H-imidazo[1,5-a]pyrazin-1-yl)-N-phenyl-carbamimidothioate Openeye Name: 2-ethyl-3-(6-methyl-8-oxo-7H-imidazo[1,5-a]pyrazin-1-yl)-1-phenyl-isothiourea CAS Name: N'-(6-methyl-8-oxo-7H-imidazo[1,5-a]pyrazin-1-yl)-N-phenylcarbamimidothioic acid ethyl ester IUPAC Name: ethyl N'-(6-methyl-8-oxo-7H-imidazo[1,5-a]pyrazin-1-yl)-N-phenylcarbamimidothioate Traditional Name: 2-ethyl-3-(8-keto-6-methyl-7H-imidazo[1,5-a]pyrazin-1-yl)-1-phenyl-isothiourea Formula: C16H17N5OS MolecularWeight: 327.40408

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=NC1=C2C(=O)NC(=CN2C=N1)C)NC3=CC=CC=C3

Isomeric SMILES

CCS/C(=N\C1=C2C(=O)NC(=CN2C=N1)C)/NC3=CC=CC=C3

InChI

InChI=1S/C16H17N5OS/c1-3-23-16(19-12-7-5-4-6-8-12)20-14-13-15(22)18-11(2)9-21(13)10-17-14/h4-10H,3H2,1-2H3,(H,18,22)(H,19,20)