N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]pentanamide

Systemtic Name: N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]pentanamide Openeye Name: N-[(4-guanidinosulfonylphenyl)carbamothioyl]pentanamide CAS Name: N-[[4-(diaminomethylideneamino)sulfonylanilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[4-(diaminomethylideneamino)sulfonylphenyl]carbamothioyl]pentanamide Traditional Name: N-[(4-guanidinosulfonylphenyl)thiocarbamoyl]valeramide Formula: C13H19N5O3S2 MolecularWeight: 357.45166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N=C(N)N

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N=C(N)N

InChI

InChI=1S/C13H19N5O3S2/c1-2-3-4-11(19)17-13(22)16-9-5-7-10(8-6-9)23(20,21)18-12(14)15/h5-8H,2-4H2,1H3,(H4,14,15,18)(H2,16,17,19,22)