6-[(3S)-3-azanylpiperidin-1-yl]-3-methyl-4-oxidanylidene-5-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile

Systemtic Name: 6-[(3S)-3-azanylpiperidin-1-yl]-3-methyl-4-oxidanylidene-5-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 6-[(3S)-3-amino-1-piperidyl]-3-methyl-4-oxo-5-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile CAS Name: 6-[(3S)-3-amino-1-piperidinyl]-3-methyl-4-oxo-5-phenyl-7-pyrrolo[3,2-d]pyrimidinecarbonitrile IUPAC Name: 6-[(3S)-3-aminopiperidin-1-yl]-3-methyl-4-oxo-5-phenylpyrrolo[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 6-[(3S)-3-aminopiperidino]-4-keto-3-methyl-5-phenyl-pyrrolo[3,2-d]pyrimidine-7-carbonitrile Formula: C19H20N6O MolecularWeight: 348.4017

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C(C1=O)N(C(=C2C#N)N3CCCC(C3)N)C4=CC=CC=C4

Isomeric SMILES

CN1C=NC2=C(C1=O)N(C(=C2C#N)N3CCC[C@@H](C3)N)C4=CC=CC=C4

InChI

InChI=1S/C19H20N6O/c1-23-12-22-16-15(10-20)18(24-9-5-6-13(21)11-24)25(17(16)19(23)26)14-7-3-2-4-8-14/h2-4,7-8,12-13H,5-6,9,11,21H2,1H3/t13-/m0/s1