N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[(4-guanidinosulfonylphenyl)carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[4-(diaminomethylideneamino)sulfonylanilino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[[4-(diaminomethylideneamino)sulfonylphenyl]carbamothioyl]-3-propoxybenzamide Traditional Name: N-[(4-guanidinosulfonylphenyl)thiocarbamoyl]-3-propoxy-benzamide Formula: C18H21N5O4S2 MolecularWeight: 435.52044

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N

InChI

InChI=1S/C18H21N5O4S2/c1-2-10-27-14-5-3-4-12(11-14)16(24)22-18(28)21-13-6-8-15(9-7-13)29(25,26)23-17(19)20/h3-9,11H,2,10H2,1H3,(H4,19,20,23)(H2,21,22,24,28)