5-[(8-chloranylquinolin-2-yl)amino]-3-[(1-methylpiperidin-3-yl)methoxy]pyrazine-2-carbonitrile

Systemtic Name: 5-[(8-chloranylquinolin-2-yl)amino]-3-[(1-methylpiperidin-3-yl)methoxy]pyrazine-2-carbonitrile Openeye Name: 5-[(8-chloro-2-quinolyl)amino]-3-[(1-methyl-3-piperidyl)methoxy]pyrazine-2-carbonitrile CAS Name: 5-[(8-chloro-2-quinolinyl)amino]-3-[(1-methyl-3-piperidinyl)methoxy]-2-pyrazinecarbonitrile IUPAC Name: 5-[(8-chloroquinolin-2-yl)amino]-3-[(1-methylpiperidin-3-yl)methoxy]pyrazine-2-carbonitrile Traditional Name: 5-[(8-chloro-2-quinolyl)amino]-3-[(1-methyl-3-piperidyl)methoxy]pyrazinonitrile Formula: C21H21ClN6O MolecularWeight: 408.88404

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)COC2=NC(=CN=C2C#N)NC3=NC4=C(C=CC=C4Cl)C=C3

Isomeric SMILES

CN1CCCC(C1)COC2=NC(=CN=C2C#N)NC3=NC4=C(C=CC=C4Cl)C=C3

InChI

InChI=1S/C21H21ClN6O/c1-28-9-3-4-14(12-28)13-29-21-17(10-23)24-11-19(27-21)25-18-8-7-15-5-2-6-16(22)20(15)26-18/h2,5-8,11,14H,3-4,9,12-13H2,1H3,(H,25,26,27)