[4-(2-methylsulfonylphenyl)phenyl] N-[(2-carbamimidoylphenyl)methyl]-N-propyl-carbamate

Systemtic Name: [4-(2-methylsulfonylphenyl)phenyl] N-[(2-carbamimidoylphenyl)methyl]-N-propyl-carbamate Openeye Name: [4-(2-methylsulfonylphenyl)phenyl] N-[(2-carbamimidoylphenyl)methyl]-N-propyl-carbamate CAS Name: N-[(2-carbamimidoylphenyl)methyl]-N-propylcarbamic acid [4-(2-methylsulfonylphenyl)phenyl] ester IUPAC Name: [4-(2-methylsulfonylphenyl)phenyl] N-[(2-carbamimidoylphenyl)methyl]-N-propylcarbamate Traditional Name: N-(2-amidinobenzyl)-N-propyl-carbamic acid [4-(2-mesylphenyl)phenyl] ester Formula: C25H27N3O4S MolecularWeight: 465.56458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1C(=N)N)C(=O)OC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CCCN(CC1=CC=CC=C1C(=N)N)C(=O)OC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C25H27N3O4S/c1-3-16-28(17-19-8-4-5-10-22(19)24(26)27)25(29)32-20-14-12-18(13-15-20)21-9-6-7-11-23(21)33(2,30)31/h4-15H,3,16-17H2,1-2H3,(H3,26,27)