7-but-2-ynyl-2-methoxy-1-(2-methoxyethyl)-8-piperazin-1-yl-purin-6-one hydrochloride

Systemtic Name: 7-but-2-ynyl-2-methoxy-1-(2-methoxyethyl)-8-piperazin-1-yl-purin-6-one hydrochloride Openeye Name: 7-but-2-ynyl-2-methoxy-1-(2-methoxyethyl)-8-piperazin-1-yl-purin-6-one hydrochloride CAS Name: 7-but-2-ynyl-2-methoxy-1-(2-methoxyethyl)-8-(1-piperazinyl)-6-purinone hydrochloride IUPAC Name: 7-but-2-ynyl-2-methoxy-1-(2-methoxyethyl)-8-piperazin-1-ylpurin-6-one hydrochloride Traditional Name: 7-but-2-ynyl-2-methoxy-1-(2-methoxyethyl)-8-piperazino-purin-6-one hydrochloride Formula: C17H25ClN6O3 MolecularWeight: 396.8718

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C2=C(N=C1N3CCNCC3)N=C(N(C2=O)CCOC)OC.Cl

Isomeric SMILES

CC#CCN1C2=C(N=C1N3CCNCC3)N=C(N(C2=O)CCOC)OC.Cl

InChI

InChI=1S/C17H24N6O3.ClH/c1-4-5-8-22-13-14(19-16(22)21-9-6-18-7-10-21)20-17(26-3)23(15(13)24)11-12-25-2;/h18H,6-12H2,1-3H3;1H