[3-azanyl-5-[3-[methyl-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)carbonyl-amino]propyl]pyrazol-4-ylidene]methylideneazanide

Systemtic Name: [3-azanyl-5-[3-[methyl-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)carbonyl-amino]propyl]pyrazol-4-ylidene]methylideneazanide Openeye Name: [3-amino-5-[3-[methyl-[1-phenyl-3-(2-thienyl)pyrazole-4-carbonyl]amino]propyl]pyrazol-4-ylidene]methyleneazanide CAS Name: [3-amino-5-[3-[methyl-[oxo-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methyl]amino]propyl]-4-pyrazolylidene]methylideneazanide IUPAC Name: [3-amino-5-[3-[methyl-(1-phenyl-3-thiophen-2-ylpyrazole-4-carbonyl)amino]propyl]pyrazol-4-ylidene]methylideneazanide Traditional Name: [3-amino-5-[3-[methyl-[1-phenyl-3-(2-thienyl)pyrazole-4-carbonyl]amino]propyl]pyrazol-4-ylidene]methyleneazanide Formula: C22H20N7OS- MolecularWeight: 430.5055

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=NN=C(C1=C=[N-])N)C(=O)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CN(CCCC1=NN=C(C1=C=[N-])N)C(=O)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H20N7OS/c1-28(11-5-9-18-16(13-23)21(24)26-25-18)22(30)17-14-29(15-7-3-2-4-8-15)27-20(17)19-10-6-12-31-19/h2-4,6-8,10,12,14H,5,9,11H2,1H3,(H2,24,26)/q-1