1-[[4-(aminomethyl)phenyl]methyl]-3-cyclopentyl-3-methyl-1-(naphthalen-2-ylsulfonylamino)urea hydrochloride

Systemtic Name: 1-[[4-(aminomethyl)phenyl]methyl]-3-cyclopentyl-3-methyl-1-(naphthalen-2-ylsulfonylamino)urea hydrochloride Openeye Name: 1-[[4-(aminomethyl)phenyl]methyl]-3-cyclopentyl-3-methyl-1-(2-naphthylsulfonylamino)urea hydrochloride CAS Name: 1-[[4-(aminomethyl)phenyl]methyl]-3-cyclopentyl-3-methyl-1-(2-naphthalenylsulfonylamino)urea hydrochloride IUPAC Name: 1-[[4-(aminomethyl)phenyl]methyl]-3-cyclopentyl-3-methyl-1-(naphthalen-2-ylsulfonylamino)urea hydrochloride Traditional Name: 1-[4-(aminomethyl)benzyl]-3-cyclopentyl-3-methyl-1-(2-naphthylsulfonylamino)urea hydrochloride Formula: C25H31ClN4O3S MolecularWeight: 503.05664

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCC1)C(=O)N(CC2=CC=C(C=C2)CN)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3.Cl

Isomeric SMILES

CN(C1CCCC1)C(=O)N(CC2=CC=C(C=C2)CN)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3.Cl

InChI

InChI=1S/C25H30N4O3S.ClH/c1-28(23-8-4-5-9-23)25(30)29(18-20-12-10-19(17-26)11-13-20)27-33(31,32)24-15-14-21-6-2-3-7-22(21)16-24;/h2-3,6-7,10-16,23,27H,4-5,8-9,17-18,26H2,1H3;1H