1-[4-(2-adamantylsulfamoyl)phenyl]-3-(3-carbamimidoylphenyl)urea

Systemtic Name: 1-[4-(2-adamantylsulfamoyl)phenyl]-3-(3-carbamimidoylphenyl)urea Openeye Name: 1-[4-(2-adamantylsulfamoyl)phenyl]-3-(3-carbamimidoylphenyl)urea CAS Name: 1-[4-(2-adamantylsulfamoyl)phenyl]-3-(3-carbamimidoylphenyl)urea IUPAC Name: 1-[4-(2-adamantylsulfamoyl)phenyl]-3-(3-carbamimidoylphenyl)urea Traditional Name: 1-[4-(2-adamantylsulfamoyl)phenyl]-3-(3-amidinophenyl)urea Formula: C24H29N5O3S MolecularWeight: 467.58376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NS(=O)(=O)C4=CC=C(C=C4)NC(=O)NC5=CC=CC(=C5)C(=N)N

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NS(=O)(=O)C4=CC=C(C=C4)NC(=O)NC5=CC=CC(=C5)C(=N)N

InChI

InChI=1S/C24H29N5O3S/c25-23(26)16-2-1-3-20(13-16)28-24(30)27-19-4-6-21(7-5-19)33(31,32)29-22-17-9-14-8-15(11-17)12-18(22)10-14/h1-7,13-15,17-18,22,29H,8-12H2,(H3,25,26)(H2,27,28,30)