1,2-bis[7-[(4-chloranyl-3-ethanoyl-phenyl)sulfamoyl]naphthalen-2-yl]guanidine

Systemtic Name: 1,2-bis[7-[(4-chloranyl-3-ethanoyl-phenyl)sulfamoyl]naphthalen-2-yl]guanidine Openeye Name: 1,2-bis[7-[(3-acetyl-4-chloro-phenyl)sulfamoyl]-2-naphthyl]guanidine CAS Name: 1,2-bis[7-[(3-acetyl-4-chlorophenyl)sulfamoyl]-2-naphthalenyl]guanidine IUPAC Name: 1,2-bis[7-[(3-acetyl-4-chlorophenyl)sulfamoyl]naphthalen-2-yl]guanidine Traditional Name: 1,2-bis[7-[(3-acetyl-4-chloro-phenyl)sulfamoyl]-2-naphthyl]guanidine Formula: C37H29Cl2N5O6S2 MolecularWeight: 774.69206

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)NS(=O)(=O)C2=CC3=C(C=CC(=C3)NC(=NC4=CC5=C(C=C4)C=CC(=C5)S(=O)(=O)NC6=CC(=C(C=C6)Cl)C(=O)C)N)C=C2)Cl

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)NS(=O)(=O)C2=CC3=C(C=CC(=C3)NC(=NC4=CC5=C(C=C4)C=CC(=C5)S(=O)(=O)NC6=CC(=C(C=C6)Cl)C(=O)C)N)C=C2)Cl

InChI

InChI=1S/C37H29Cl2N5O6S2/c1-21(45)33-19-29(9-13-35(33)38)43-51(47,48)31-11-5-23-3-7-27(15-25(23)17-31)41-37(40)42-28-8-4-24-6-12-32(18-26(24)16-28)52(49,50)44-30-10-14-36(39)34(20-30)22(2)46/h3-20,43-44H,1-2H3,(H3,40,41,42)