[4-(propan-2-ylcarbamothioylamino)phenyl]sulfonyl-pyrimidin-2-yl-azanide

Systemtic Name: [4-(propan-2-ylcarbamothioylamino)phenyl]sulfonyl-pyrimidin-2-yl-azanide Openeye Name: [4-(isopropylcarbamothioylamino)phenyl]sulfonyl-pyrimidin-2-yl-azanide CAS Name: [4-[[(propan-2-ylamino)-sulfanylidenemethyl]amino]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: [4-(propan-2-ylcarbamothioylamino)phenyl]sulfonyl-pyrimidin-2-ylazanide Traditional Name: [4-(isopropylthiocarbamoylamino)phenyl]sulfonyl-(2-pyrimidyl)azanide Formula: C14H16N5O2S2- MolecularWeight: 350.43914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)[N-]C2=NC=CC=N2

Isomeric SMILES

CC(C)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)[N-]C2=NC=CC=N2

InChI

InChI=1S/C14H17N5O2S2/c1-10(2)17-14(22)18-11-4-6-12(7-5-11)23(20,21)19-13-15-8-3-9-16-13/h3-10H,1-2H3,(H3,15,16,17,18,19,22)/p-1