(2E)-4-azanyl-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-6-pyrrolidin-3-yl-1H-pyrimidine-5-carbonitrile hydrochloride

Systemtic Name: (2E)-4-azanyl-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-6-pyrrolidin-3-yl-1H-pyrimidine-5-carbonitrile hydrochloride Openeye Name: (2E)-4-amino-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-6-pyrrolidin-3-yl-1H-pyrimidine-5-carbonitrile hydrochloride CAS Name: (2E)-4-amino-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-6-(3-pyrrolidinyl)-1H-pyrimidine-5-carbonitrile hydrochloride IUPAC Name: (2E)-4-amino-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-6-pyrrolidin-3-yl-1H-pyrimidine-5-carbonitrile hydrochloride Traditional Name: (2E)-4-amino-2-(6-ketocyclohexa-2,4-dien-1-ylidene)-6-pyrrolidin-3-yl-1H-pyrimidine-5-carbonitrile hydrochloride Formula: C15H16ClN5O MolecularWeight: 317.77344

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1C2=C(C(=NC(=C3C=CC=CC3=O)N2)N)C#N.Cl

Isomeric SMILES

C1CNCC1C2=C(C(=N/C(=C/3\C=CC=CC3=O)/N2)N)C#N.Cl

InChI

InChI=1S/C15H15N5O.ClH/c16-7-11-13(9-5-6-18-8-9)19-15(20-14(11)17)10-3-1-2-4-12(10)21;/h1-4,9,18-19H,5-6,8H2,(H2,17,20);1H/b15-10+;