N-[(5-carbamimidoylthiophen-2-yl)methyl]-1-[3-cyclohexyl-2-(methylsulfonylamino)propanoyl]pyrrolidine-2-carboxamide

Systemtic Name: N-[(5-carbamimidoylthiophen-2-yl)methyl]-1-[3-cyclohexyl-2-(methylsulfonylamino)propanoyl]pyrrolidine-2-carboxamide Openeye Name: N-[(5-carbamimidoyl-2-thienyl)methyl]-1-[3-cyclohexyl-2-(methanesulfonamido)propanoyl]pyrrolidine-2-carboxamide CAS Name: N-[(5-carbamimidoyl-2-thiophenyl)methyl]-1-[3-cyclohexyl-2-(methanesulfonamido)-1-oxopropyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[(5-carbamimidoylthiophen-2-yl)methyl]-1-[3-cyclohexyl-2-(methanesulfonamido)propanoyl]pyrrolidine-2-carboxamide Traditional Name: N-[(5-amidino-2-thienyl)methyl]-1-[3-cyclohexyl-2-(methanesulfonamido)propanoyl]pyrrolidine-2-carboxamide Formula: C21H33N5O4S2 MolecularWeight: 483.64782

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC(CC1CCCCC1)C(=O)N2CCCC2C(=O)NCC3=CC=C(S3)C(=N)N

Isomeric SMILES

CS(=O)(=O)NC(CC1CCCCC1)C(=O)N2CCCC2C(=O)NCC3=CC=C(S3)C(=N)N

InChI

InChI=1S/C21H33N5O4S2/c1-32(29,30)25-16(12-14-6-3-2-4-7-14)21(28)26-11-5-8-17(26)20(27)24-13-15-9-10-18(31-15)19(22)23/h9-10,14,16-17,25H,2-8,11-13H2,1H3,(H3,22,23)(H,24,27)