N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]adamantane-1-carboxamide Openeye Name: N-[(4-guanidinosulfonylphenyl)carbamothioyl]adamantane-1-carboxamide CAS Name: N-[[4-(diaminomethylideneamino)sulfonylanilino]-sulfanylidenemethyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-(diaminomethylideneamino)sulfonylphenyl]carbamothioyl]adamantane-1-carboxamide Traditional Name: N-[(4-guanidinosulfonylphenyl)thiocarbamoyl]adamantane-1-carboxamide Formula: C19H25N5O3S2 MolecularWeight: 435.5635

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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)N

Isomeric SMILES

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

InChI

InChI=1S/C19H25N5O3S2/c20-17(21)24-29(26,27)15-3-1-14(2-4-15)22-18(28)23-16(25)19-8-11-5-12(9-19)7-13(6-11)10-19/h1-4,11-13H,5-10H2,(H4,20,21,24)(H2,22,23,25,28)