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

Systemtic Name: N-[(5-carbamimidoylthiophen-2-yl)methyl]-1-[3-cyclohexyl-2-(cyclohexylmethylsulfonylamino)propanoyl]pyrrolidine-2-carboxamide Openeye Name: N-[(5-carbamimidoyl-2-thienyl)methyl]-1-[3-cyclohexyl-2-(cyclohexylmethylsulfonylamino)propanoyl]pyrrolidine-2-carboxamide CAS Name: N-[(5-carbamimidoyl-2-thiophenyl)methyl]-1-[3-cyclohexyl-2-(cyclohexylmethylsulfonylamino)-1-oxopropyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[(5-carbamimidoylthiophen-2-yl)methyl]-1-[3-cyclohexyl-2-(cyclohexylmethylsulfonylamino)propanoyl]pyrrolidine-2-carboxamide Traditional Name: N-[(5-amidino-2-thienyl)methyl]-1-[3-cyclohexyl-2-(cyclohexylmethylsulfonylamino)propanoyl]pyrrolidine-2-carboxamide Formula: C27H43N5O4S2 MolecularWeight: 565.79142

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)N2CCCC2C(=O)NCC3=CC=C(S3)C(=N)N)NS(=O)(=O)CC4CCCCC4

Isomeric SMILES

C1CCC(CC1)CC(C(=O)N2CCCC2C(=O)NCC3=CC=C(S3)C(=N)N)NS(=O)(=O)CC4CCCCC4

InChI

InChI=1S/C27H43N5O4S2/c28-25(29)24-14-13-21(37-24)17-30-26(33)23-12-7-15-32(23)27(34)22(16-19-8-3-1-4-9-19)31-38(35,36)18-20-10-5-2-6-11-20/h13-14,19-20,22-23,31H,1-12,15-18H2,(H3,28,29)(H,30,33)