N-(1-carbamimidoylpiperidin-3-yl)-N-methyl-2-(naphthalen-2-ylsulfonylamino)-3-phenyl-propanamide

Systemtic Name: N-(1-carbamimidoylpiperidin-3-yl)-N-methyl-2-(naphthalen-2-ylsulfonylamino)-3-phenyl-propanamide Openeye Name: N-(1-carbamimidoyl-3-piperidyl)-N-methyl-2-(2-naphthylsulfonylamino)-3-phenyl-propanamide CAS Name: N-(1-carbamimidoyl-3-piperidinyl)-N-methyl-2-(2-naphthalenylsulfonylamino)-3-phenylpropanamide IUPAC Name: N-(1-carbamimidoylpiperidin-3-yl)-N-methyl-2-(naphthalen-2-ylsulfonylamino)-3-phenylpropanamide Traditional Name: N-(1-amidino-3-piperidyl)-N-methyl-2-(2-naphthylsulfonylamino)-3-phenyl-propionamide Formula: C26H31N5O3S MolecularWeight: 493.62104

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCN(C1)C(=N)N)C(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CN(C1CCCN(C1)C(=N)N)C(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H31N5O3S/c1-30(22-12-7-15-31(18-22)26(27)28)25(32)24(16-19-8-3-2-4-9-19)29-35(33,34)23-14-13-20-10-5-6-11-21(20)17-23/h2-6,8-11,13-14,17,22,24,29H,7,12,15-16,18H2,1H3,(H3,27,28)