2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]benzenecarbonitrile

Systemtic Name: 2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]benzenecarbonitrile Openeye Name: 2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]benzonitrile CAS Name: 2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]-2-quinazolinyl]benzonitrile IUPAC Name: 2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]benzonitrile Traditional Name: 2-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)amino]quinazolin-2-yl]benzonitrile Formula: C18H13N7 MolecularWeight: 327.34272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4C#N

Isomeric SMILES

CC1=NC(=NN1)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4C#N

InChI

InChI=1S/C18H13N7/c1-11-20-18(25-24-11)23-17-14-8-4-5-9-15(14)21-16(22-17)13-7-3-2-6-12(13)10-19/h2-9H,1H3,(H2,20,21,22,23,24,25)