N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]-3-methyl-butanamide Openeye Name: N-[(4-guanidinosulfonylphenyl)carbamothioyl]-3-methyl-butanamide CAS Name: N-[[4-(diaminomethylideneamino)sulfonylanilino]-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[[4-(diaminomethylideneamino)sulfonylphenyl]carbamothioyl]-3-methylbutanamide Traditional Name: N-[(4-guanidinosulfonylphenyl)thiocarbamoyl]-3-methyl-butyramide Formula: C13H19N5O3S2 MolecularWeight: 357.45166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N5O3S2/c1-8(2)7-11(19)17-13(22)16-9-3-5-10(6-4-9)23(20,21)18-12(14)15/h3-6,8H,7H2,1-2H3,(H4,14,15,18)(H2,16,17,19,22)