4-(2,3-dihydropyrrol-1-yl)-2-methyl-6-phenyl-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride

Systemtic Name: 4-(2,3-dihydropyrrol-1-yl)-2-methyl-6-phenyl-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride Openeye Name: 4-(2,3-dihydropyrrol-1-yl)-2-methyl-6-phenyl-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride CAS Name: 4-(2,3-dihydropyrrol-1-yl)-2-methyl-6-phenyl-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride IUPAC Name: 4-(2,3-dihydropyrrol-1-yl)-2-methyl-6-phenyl-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride Traditional Name: 2-methyl-6-phenyl-4-(2-pyrrolin-1-yl)-5H-pyrrolo[3,2-d]pyrimidine hydrate hydrochloride Formula: C17H19ClN4O MolecularWeight: 330.81196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)N3CCC=C3)NC(=C2)C4=CC=CC=C4.O.Cl

Isomeric SMILES

CC1=NC2=C(C(=N1)N3CCC=C3)NC(=C2)C4=CC=CC=C4.O.Cl

InChI

InChI=1S/C17H16N4.ClH.H2O/c1-12-18-15-11-14(13-7-3-2-4-8-13)20-16(15)17(19-12)21-9-5-6-10-21;;/h2-5,7-9,11,20H,6,10H2,1H3;1H;1H2