N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]-2-(2-methoxyethoxy)benzamide

Systemtic Name: N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]-2-(2-methoxyethoxy)benzamide Openeye Name: N-[(4-guanidinosulfonylphenyl)carbamothioyl]-2-(2-methoxyethoxy)benzamide CAS Name: N-[[4-(diaminomethylideneamino)sulfonylanilino]-sulfanylidenemethyl]-2-(2-methoxyethoxy)benzamide IUPAC Name: N-[[4-(diaminomethylideneamino)sulfonylphenyl]carbamothioyl]-2-(2-methoxyethoxy)benzamide Traditional Name: N-[(4-guanidinosulfonylphenyl)thiocarbamoyl]-2-(2-methoxyethoxy)benzamide Formula: C18H21N5O5S2 MolecularWeight: 451.51984

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N

Isomeric SMILES

COCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N

InChI

InChI=1S/C18H21N5O5S2/c1-27-10-11-28-15-5-3-2-4-14(15)16(24)22-18(29)21-12-6-8-13(9-7-12)30(25,26)23-17(19)20/h2-9H,10-11H2,1H3,(H4,19,20,23)(H2,21,22,24,29)