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

Systemtic Name: N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]-4-methoxy-benzamide Openeye Name: N-[(4-guanidinosulfonylphenyl)carbamothioyl]-4-methoxy-benzamide CAS Name: N-[[4-(diaminomethylideneamino)sulfonylanilino]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: N-[[4-(diaminomethylideneamino)sulfonylphenyl]carbamothioyl]-4-methoxybenzamide Traditional Name: N-[(4-guanidinosulfonylphenyl)thiocarbamoyl]-4-methoxy-benzamide Formula: C16H17N5O4S2 MolecularWeight: 407.46728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N

InChI

InChI=1S/C16H17N5O4S2/c1-25-12-6-2-10(3-7-12)14(22)20-16(26)19-11-4-8-13(9-5-11)27(23,24)21-15(17)18/h2-9H,1H3,(H4,17,18,21)(H2,19,20,22,26)