5-[(N-azanyl-N'-prop-2-enyl-carbamimidoyl)sulfamoyl]-2-chloranyl-N-phenyl-4-sulfanyl-benzamide

Systemtic Name: 5-[(N-azanyl-N'-prop-2-enyl-carbamimidoyl)sulfamoyl]-2-chloranyl-N-phenyl-4-sulfanyl-benzamide Openeye Name: 5-[(N'-allyl-N-amino-carbamimidoyl)sulfamoyl]-2-chloro-N-phenyl-4-sulfanyl-benzamide CAS Name: 2-chloro-5-[[hydrazinyl(prop-2-enylimino)methyl]sulfamoyl]-4-mercapto-N-phenylbenzamide IUPAC Name: 5-[(N-amino-N'-prop-2-enylcarbamimidoyl)sulfamoyl]-2-chloro-N-phenyl-4-sulfanylbenzamide Traditional Name: 5-[(N'-allyl-N-amino-amidino)sulfamoyl]-2-chloro-4-mercapto-N-phenyl-benzamide Formula: C17H18ClN5O3S2 MolecularWeight: 439.93952

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN=C(NN)NS(=O)(=O)C1=C(C=C(C(=C1)C(=O)NC2=CC=CC=C2)Cl)S

Isomeric SMILES

C=CCN=C(NN)NS(=O)(=O)C1=C(C=C(C(=C1)C(=O)NC2=CC=CC=C2)Cl)S

InChI

InChI=1S/C17H18ClN5O3S2/c1-2-8-20-17(22-19)23-28(25,26)15-9-12(13(18)10-14(15)27)16(24)21-11-6-4-3-5-7-11/h2-7,9-10,27H,1,8,19H2,(H,21,24)(H2,20,22,23)