1-carbamimidoyl-N-[[2-oxidanylideneethyl-(1-pyrrolidin-1-ylnaphthalen-2-yl)sulfonyl-amino]methyl]piperidine-3-carboxamide

Systemtic Name: 1-carbamimidoyl-N-[[2-oxidanylideneethyl-(1-pyrrolidin-1-ylnaphthalen-2-yl)sulfonyl-amino]methyl]piperidine-3-carboxamide Openeye Name: 1-carbamimidoyl-N-[[2-oxoethyl-[(1-pyrrolidin-1-yl-2-naphthyl)sulfonyl]amino]methyl]piperidine-3-carboxamide CAS Name: 1-carbamimidoyl-N-[[2-oxoethyl-[[1-(1-pyrrolidinyl)-2-naphthalenyl]sulfonyl]amino]methyl]-3-piperidinecarboxamide IUPAC Name: 1-carbamimidoyl-N-[[2-oxoethyl-(1-pyrrolidin-1-ylnaphthalen-2-yl)sulfonylamino]methyl]piperidine-3-carboxamide Traditional Name: 1-amidino-N-[[2-ketoethyl-[(1-pyrrolidino-2-naphthyl)sulfonyl]amino]methyl]nipecotamide Formula: C24H32N6O4S MolecularWeight: 500.61368

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC3=CC=CC=C32)S(=O)(=O)N(CC=O)CNC(=O)C4CCCN(C4)C(=N)N

Isomeric SMILES

C1CCN(C1)C2=C(C=CC3=CC=CC=C32)S(=O)(=O)N(CC=O)CNC(=O)C4CCCN(C4)C(=N)N

InChI

InChI=1S/C24H32N6O4S/c25-24(26)29-13-5-7-19(16-29)23(32)27-17-30(14-15-31)35(33,34)21-10-9-18-6-1-2-8-20(18)22(21)28-11-3-4-12-28/h1-2,6,8-10,15,19H,3-5,7,11-14,16-17H2,(H3,25,26)(H,27,32)