N-[(6E)-6-(6-azanyl-5-cyano-4-piperidin-3-yl-1H-pyridin-2-ylidene)-5-oxidanylidene-cyclohexa-1,3-dien-1-yl]ethanamide hydrochloride

Systemtic Name: N-[(6E)-6-(6-azanyl-5-cyano-4-piperidin-3-yl-1H-pyridin-2-ylidene)-5-oxidanylidene-cyclohexa-1,3-dien-1-yl]ethanamide hydrochloride Openeye Name: N-[(6E)-6-[6-amino-5-cyano-4-(3-piperidyl)-1H-pyridin-2-ylidene]-5-oxo-cyclohexa-1,3-dien-1-yl]acetamide hydrochloride CAS Name: N-[(6E)-6-[6-amino-5-cyano-4-(3-piperidinyl)-1H-pyridin-2-ylidene]-5-oxo-1-cyclohexa-1,3-dienyl]acetamide hydrochloride IUPAC Name: N-[(6E)-6-(6-amino-5-cyano-4-piperidin-3-yl-1H-pyridin-2-ylidene)-5-oxocyclohexa-1,3-dien-1-yl]acetamide hydrochloride Traditional Name: N-[(6E)-6-[6-amino-5-cyano-4-(3-piperidyl)-1H-pyridin-2-ylidene]-5-keto-cyclohexa-1,3-dien-1-yl]acetamide hydrochloride Formula: C19H22ClN5O2 MolecularWeight: 387.86328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=O)C1=C2C=C(C(=C(N2)N)C#N)C3CCCNC3.Cl

Isomeric SMILES

CC(=O)NC\1=CC=CC(=O)/C1=C/2\C=C(C(=C(N2)N)C#N)C3CCCNC3.Cl

InChI

InChI=1S/C19H21N5O2.ClH/c1-11(25)23-15-5-2-6-17(26)18(15)16-8-13(12-4-3-7-22-10-12)14(9-20)19(21)24-16;/h2,5-6,8,12,22,24H,3-4,7,10,21H2,1H3,(H,23,25);1H/b18-16+;