N-[4-carbamimidoyl-2-[2-(ethylsulfonylamino)-3-phenyl-propanoyl]phenyl]-N-methyl-pyrrolidine-2-carboxamide hydrochloride

Systemtic Name: N-[4-carbamimidoyl-2-[2-(ethylsulfonylamino)-3-phenyl-propanoyl]phenyl]-N-methyl-pyrrolidine-2-carboxamide hydrochloride Openeye Name: N-[4-carbamimidoyl-2-[2-(ethylsulfonylamino)-3-phenyl-propanoyl]phenyl]-N-methyl-pyrrolidine-2-carboxamide hydrochloride CAS Name: N-[4-carbamimidoyl-2-[2-(ethylsulfonylamino)-1-oxo-3-phenylpropyl]phenyl]-N-methyl-2-pyrrolidinecarboxamide hydrochloride IUPAC Name: N-[4-carbamimidoyl-2-[2-(ethylsulfonylamino)-3-phenylpropanoyl]phenyl]-N-methylpyrrolidine-2-carboxamide hydrochloride Traditional Name: N-[4-amidino-2-[2-(esylamino)-3-phenyl-propanoyl]phenyl]-N-methyl-pyrrolidine-2-carboxamide hydrochloride Formula: C24H32ClN5O4S MolecularWeight: 522.05998

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC(CC1=CC=CC=C1)C(=O)C2=C(C=CC(=C2)C(=N)N)N(C)C(=O)C3CCCN3.Cl

Isomeric SMILES

CCS(=O)(=O)NC(CC1=CC=CC=C1)C(=O)C2=C(C=CC(=C2)C(=N)N)N(C)C(=O)C3CCCN3.Cl

InChI

InChI=1S/C24H31N5O4S.ClH/c1-3-34(32,33)28-20(14-16-8-5-4-6-9-16)22(30)18-15-17(23(25)26)11-12-21(18)29(2)24(31)19-10-7-13-27-19;/h4-6,8-9,11-12,15,19-20,27-28H,3,7,10,13-14H2,1-2H3,(H3,25,26);1H