[5-[1-[2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]pyrazol-4-yl]thiophen-2-yl]methylazanium

Systemtic Name: [5-[1-[2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]pyrazol-4-yl]thiophen-2-yl]methylazanium Openeye Name: [5-[1-[2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]-2-oxo-ethyl]pyrazol-4-yl]-2-thienyl]methylammonium CAS Name: [5-[1-[2-[(5-methyl-2-phenyl-3-pyrazolyl)amino]-2-oxoethyl]-4-pyrazolyl]-2-thiophenyl]methylammonium IUPAC Name: [5-[1-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]pyrazol-4-yl]thiophen-2-yl]methylazanium Traditional Name: [5-[1-[2-keto-2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]ethyl]pyrazol-4-yl]-2-thienyl]methylammonium Formula: C20H21N6OS+ MolecularWeight: 393.48534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CN2C=C(C=N2)C3=CC=C(S3)C[NH3+])C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CN2C=C(C=N2)C3=CC=C(S3)C[NH3+])C4=CC=CC=C4

InChI

InChI=1S/C20H20N6OS/c1-14-9-19(26(24-14)16-5-3-2-4-6-16)23-20(27)13-25-12-15(11-22-25)18-8-7-17(10-21)28-18/h2-9,11-12H,10,13,21H2,1H3,(H,23,27)/p+1