N-[(4-carbamimidoyl-5-methyl-thiophen-2-yl)methyl]-1-[2-(methylsulfonylamino)-3,3-diphenyl-propanoyl]pyrrolidine-2-carboxamide

Systemtic Name: N-[(4-carbamimidoyl-5-methyl-thiophen-2-yl)methyl]-1-[2-(methylsulfonylamino)-3,3-diphenyl-propanoyl]pyrrolidine-2-carboxamide Openeye Name: N-[(4-carbamimidoyl-5-methyl-2-thienyl)methyl]-1-[2-(methanesulfonamido)-3,3-diphenyl-propanoyl]pyrrolidine-2-carboxamide CAS Name: N-[(4-carbamimidoyl-5-methyl-2-thiophenyl)methyl]-1-[2-(methanesulfonamido)-1-oxo-3,3-diphenylpropyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[(4-carbamimidoyl-5-methylthiophen-2-yl)methyl]-1-[2-(methanesulfonamido)-3,3-diphenylpropanoyl]pyrrolidine-2-carboxamide Traditional Name: N-[(4-amidino-5-methyl-2-thienyl)methyl]-1-[2-(methanesulfonamido)-3,3-diphenyl-propanoyl]pyrrolidine-2-carboxamide Formula: C28H33N5O4S2 MolecularWeight: 567.72272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)CNC(=O)C2CCCN2C(=O)C(C(C3=CC=CC=C3)C4=CC=CC=C4)NS(=O)(=O)C)C(=N)N

Isomeric SMILES

CC1=C(C=C(S1)CNC(=O)C2CCCN2C(=O)C(C(C3=CC=CC=C3)C4=CC=CC=C4)NS(=O)(=O)C)C(=N)N

InChI

InChI=1S/C28H33N5O4S2/c1-18-22(26(29)30)16-21(38-18)17-31-27(34)23-14-9-15-33(23)28(35)25(32-39(2,36)37)24(19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-8,10-13,16,23-25,32H,9,14-15,17H2,1-2H3,(H3,29,30)(H,31,34)