[4-[[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]carbamothioylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide

Systemtic Name: [4-[[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]carbamothioylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide Openeye Name: [4-[[1-(1-naphthylmethyl)pyrazol-4-yl]carbamothioylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide CAS Name: [4-[[[[1-(1-naphthalenylmethyl)-4-pyrazolyl]amino]-sulfanylidenemethyl]amino]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: [4-[[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]carbamothioylamino]phenyl]sulfonyl-pyrimidin-2-ylazanide Traditional Name: [4-[[1-(1-naphthylmethyl)pyrazol-4-yl]thiocarbamoylamino]phenyl]sulfonyl-(2-pyrimidyl)azanide Formula: C25H20N7O2S2- MolecularWeight: 514.602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CN3C=C(C=N3)NC(=S)NC4=CC=C(C=C4)S(=O)(=O)[N-]C5=NC=CC=N5

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CN3C=C(C=N3)NC(=S)NC4=CC=C(C=C4)S(=O)(=O)[N-]C5=NC=CC=N5

InChI

InChI=1S/C25H21N7O2S2/c33-36(34,31-24-26-13-4-14-27-24)22-11-9-20(10-12-22)29-25(35)30-21-15-28-32(17-21)16-19-7-3-6-18-5-1-2-8-23(18)19/h1-15,17H,16H2,(H3,26,27,29,30,31,35)/p-1