2-[[6-cyano-5-(4-phenylpiperazin-1-yl)-1,2,4-triazin-3-yl]amino]ethylcarbamic acid

Systemtic Name: 2-[[6-cyano-5-(4-phenylpiperazin-1-yl)-1,2,4-triazin-3-yl]amino]ethylcarbamic acid Openeye Name: 2-[[6-cyano-5-(4-phenylpiperazin-1-yl)-1,2,4-triazin-3-yl]amino]ethylcarbamic acid CAS Name: 2-[[6-cyano-5-(4-phenyl-1-piperazinyl)-1,2,4-triazin-3-yl]amino]ethylcarbamic acid IUPAC Name: 2-[[6-cyano-5-(4-phenylpiperazin-1-yl)-1,2,4-triazin-3-yl]amino]ethylcarbamic acid Traditional Name: 2-[[6-cyano-5-(4-phenylpiperazino)-1,2,4-triazin-3-yl]amino]ethylcarbamic acid Formula: C17H20N8O2 MolecularWeight: 368.3931

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(N=NC(=N3)NCCNC(=O)O)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(N=NC(=N3)NCCNC(=O)O)C#N

InChI

InChI=1S/C17H20N8O2/c18-12-14-15(21-16(23-22-14)19-6-7-20-17(26)27)25-10-8-24(9-11-25)13-4-2-1-3-5-13/h1-5,20H,6-11H2,(H,26,27)(H,19,21,23)