N-[(1-carbamimidoylpiperidin-3-yl)methyl]-2-(naphthalen-2-ylsulfonylamino)-N-thiophen-2-yl-propanamide

Systemtic Name: N-[(1-carbamimidoylpiperidin-3-yl)methyl]-2-(naphthalen-2-ylsulfonylamino)-N-thiophen-2-yl-propanamide Openeye Name: N-[(1-carbamimidoyl-3-piperidyl)methyl]-2-(2-naphthylsulfonylamino)-N-(2-thienyl)propanamide CAS Name: N-[(1-carbamimidoyl-3-piperidinyl)methyl]-2-(2-naphthalenylsulfonylamino)-N-thiophen-2-ylpropanamide IUPAC Name: N-[(1-carbamimidoylpiperidin-3-yl)methyl]-2-(naphthalen-2-ylsulfonylamino)-N-thiophen-2-ylpropanamide Traditional Name: N-[(1-amidino-3-piperidyl)methyl]-2-(2-naphthylsulfonylamino)-N-(2-thienyl)propionamide Formula: C24H29N5O3S2 MolecularWeight: 499.64876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CC1CCCN(C1)C(=N)N)C2=CC=CS2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C(=O)N(CC1CCCN(C1)C(=N)N)C2=CC=CS2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H29N5O3S2/c1-17(27-34(31,32)21-11-10-19-7-2-3-8-20(19)14-21)23(30)29(22-9-5-13-33-22)16-18-6-4-12-28(15-18)24(25)26/h2-3,5,7-11,13-14,17-18,27H,4,6,12,15-16H2,1H3,(H3,25,26)