N'-[4-(1-adamantylcarbonylcarbamothioylamino)phenyl]sulfonylcarbamimidate

Systemtic Name: N'-[4-(1-adamantylcarbonylcarbamothioylamino)phenyl]sulfonylcarbamimidate Openeye Name: N'-[4-(adamantane-1-carbonylcarbamothioylamino)phenyl]sulfonylcarbamimidate CAS Name: N'-[4-[[[[1-adamantyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]phenyl]sulfonylcarbamimidate IUPAC Name: N'-[4-(adamantane-1-carbonylcarbamothioylamino)phenyl]sulfonylcarbamimidate Traditional Name: N'-[4-(adamantane-1-carbonylthiocarbamoylamino)phenyl]sulfonylcarbamimidate Formula: C19H23N4O4S2- MolecularWeight: 435.54032

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=CC=C(C=C4)S(=O)(=O)N=C(N)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=CC=C(C=C4)S(=O)(=O)N=C(N)[O-]

InChI

InChI=1S/C19H24N4O4S2/c20-17(25)23-29(26,27)15-3-1-14(2-4-15)21-18(28)22-16(24)19-8-11-5-12(9-19)7-13(6-11)10-19/h1-4,11-13H,5-10H2,(H3,20,23,25)(H2,21,22,24,28)/p-1