2,7-dimethyl-6-phenyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride

Systemtic Name: 2,7-dimethyl-6-phenyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride Openeye Name: 2,7-dimethyl-6-phenyl-4-(1-piperidyl)-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride CAS Name: 2,7-dimethyl-6-phenyl-4-(1-piperidinyl)-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride IUPAC Name: 2,7-dimethyl-6-phenyl-4-piperidin-1-yl-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride Traditional Name: 2,7-dimethyl-6-phenyl-4-piperidino-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride Formula: C19H25ClN4O MolecularWeight: 360.881

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1N=C(N=C2N3CCCCC3)C)C4=CC=CC=C4.O.Cl

Isomeric SMILES

CC1=C(NC2=C1N=C(N=C2N3CCCCC3)C)C4=CC=CC=C4.O.Cl

InChI

InChI=1S/C19H22N4.ClH.H2O/c1-13-16(15-9-5-3-6-10-15)22-18-17(13)20-14(2)21-19(18)23-11-7-4-8-12-23;;/h3,5-6,9-10,22H,4,7-8,11-12H2,1-2H3;1H;1H2