N-[3-(3-azanyl-4-cyano-1H-pyrazol-2-ium-5-yl)propyl]-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: N-[3-(3-azanyl-4-cyano-1H-pyrazol-2-ium-5-yl)propyl]-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: N-[3-(3-amino-4-cyano-1H-pyrazol-2-ium-5-yl)propyl]-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: N-[3-(3-amino-4-cyano-1H-pyrazol-2-ium-5-yl)propyl]-3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: N-[3-(3-amino-4-cyano-1H-pyrazol-2-ium-5-yl)propyl]-3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: N-[3-(3-amino-4-cyano-1H-pyrazol-2-ium-5-yl)propyl]-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C20H20N7OS+ MolecularWeight: 406.4841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NCCCC3=C(C(=[NH+]N3)N)C#N)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NCCCC3=C(C(=[NH+]N3)N)C#N)C4=CC=CC=C4

InChI

InChI=1S/C20H19N7OS/c1-12-14-10-17(29-20(14)27(26-12)13-6-3-2-4-7-13)19(28)23-9-5-8-16-15(11-21)18(22)25-24-16/h2-4,6-7,10H,5,8-9H2,1H3,(H,23,28)(H3,22,24,25)/p+1