3-[[[5-(6-methylpyridin-2-yl)-4-quinoxalin-6-yl-1,3-thiazol-2-yl]amino]methyl]benzenecarbonitrile

Systemtic Name: 3-[[[5-(6-methylpyridin-2-yl)-4-quinoxalin-6-yl-1,3-thiazol-2-yl]amino]methyl]benzenecarbonitrile Openeye Name: 3-[[[5-(6-methyl-2-pyridyl)-4-quinoxalin-6-yl-thiazol-2-yl]amino]methyl]benzonitrile CAS Name: 3-[[[5-(6-methyl-2-pyridinyl)-4-(6-quinoxalinyl)-2-thiazolyl]amino]methyl]benzonitrile IUPAC Name: 3-[[[5-(6-methylpyridin-2-yl)-4-quinoxalin-6-yl-1,3-thiazol-2-yl]amino]methyl]benzonitrile Traditional Name: 3-[[[5-(6-methyl-2-pyridyl)-4-quinoxalin-6-yl-thiazol-2-yl]amino]methyl]benzonitrile Formula: C25H18N6S MolecularWeight: 434.51562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C2=C(N=C(S2)NCC3=CC=CC(=C3)C#N)C4=CC5=NC=CN=C5C=C4

Isomeric SMILES

CC1=CC=CC(=N1)C2=C(N=C(S2)NCC3=CC=CC(=C3)C#N)C4=CC5=NC=CN=C5C=C4

InChI

InChI=1S/C25H18N6S/c1-16-4-2-7-21(30-16)24-23(19-8-9-20-22(13-19)28-11-10-27-20)31-25(32-24)29-15-18-6-3-5-17(12-18)14-26/h2-13H,15H2,1H3,(H,29,31)