1-(3-chlorophenyl)-2-phenethyl-3-(phenylsulfonyl)guanidine

Systemtic Name: 1-(3-chlorophenyl)-2-phenethyl-3-(phenylsulfonyl)guanidine Openeye Name: 1-(benzenesulfonyl)-3-(3-chlorophenyl)-2-phenethyl-guanidine CAS Name: 1-(benzenesulfonyl)-3-(3-chlorophenyl)-2-phenethylguanidine IUPAC Name: 1-(benzenesulfonyl)-3-(3-chlorophenyl)-2-phenethylguanidine Traditional Name: 1-besyl-3-(3-chlorophenyl)-2-phenethyl-guanidine Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN=C(NC2=CC(=CC=C2)Cl)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCN=C(NC2=CC(=CC=C2)Cl)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H20ClN3O2S/c22-18-10-7-11-19(16-18)24-21(23-15-14-17-8-3-1-4-9-17)25-28(26,27)20-12-5-2-6-13-20/h1-13,16H,14-15H2,(H2,23,24,25)