ethyl 2-[8-azanyl-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[8-azanyl-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]sulfanylethanoate Openeye Name: ethyl 2-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]sulfanylacetate CAS Name: 2-[[8-amino-1-(1H-indol-2-yl)-3-imidazo[1,5-a]pyrazinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]sulfanylacetate Traditional Name: 2-[[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]thio]acetic acid ethyl ester Formula: C18H17N5O2S MolecularWeight: 367.42488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=C2N1C=CN=C2N)C3=CC4=CC=CC=C4N3

Isomeric SMILES

CCOC(=O)CSC1=NC(=C2N1C=CN=C2N)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C18H17N5O2S/c1-2-25-14(24)10-26-18-22-15(16-17(19)20-7-8-23(16)18)13-9-11-5-3-4-6-12(11)21-13/h3-9,21H,2,10H2,1H3,(H2,19,20)