N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]-3-butan-2-yloxy-benzamide

Systemtic Name: N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]-3-butan-2-yloxy-benzamide Openeye Name: N-[(4-guanidinosulfonylphenyl)carbamothioyl]-3-sec-butoxy-benzamide CAS Name: 3-butan-2-yloxy-N-[[4-(diaminomethylideneamino)sulfonylanilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butan-2-yloxy-N-[[4-(diaminomethylideneamino)sulfonylphenyl]carbamothioyl]benzamide Traditional Name: N-[(4-guanidinosulfonylphenyl)thiocarbamoyl]-3-sec-butoxy-benzamide Formula: C19H23N5O4S2 MolecularWeight: 449.54702

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N

Isomeric SMILES

CCC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N

InChI

InChI=1S/C19H23N5O4S2/c1-3-12(2)28-15-6-4-5-13(11-15)17(25)23-19(29)22-14-7-9-16(10-8-14)30(26,27)24-18(20)21/h4-12H,3H2,1-2H3,(H4,20,21,24)(H2,22,23,25,29)