2-[(3-carbamimidoylphenyl)methyl]-N-[2-[(5-carbamimidoylthiophen-2-yl)methylamino]-2-oxidanylidene-ethyl]-5-oxidanylidene-pyrrolidine-2-carboxamide

Systemtic Name: 2-[(3-carbamimidoylphenyl)methyl]-N-[2-[(5-carbamimidoylthiophen-2-yl)methylamino]-2-oxidanylidene-ethyl]-5-oxidanylidene-pyrrolidine-2-carboxamide Openeye Name: 2-[(3-carbamimidoylphenyl)methyl]-N-[2-[(5-carbamimidoyl-2-thienyl)methylamino]-2-oxo-ethyl]-5-oxo-pyrrolidine-2-carboxamide CAS Name: 2-[(3-carbamimidoylphenyl)methyl]-N-[2-[(5-carbamimidoyl-2-thiophenyl)methylamino]-2-oxoethyl]-5-oxo-2-pyrrolidinecarboxamide IUPAC Name: 2-[(3-carbamimidoylphenyl)methyl]-N-[2-[(5-carbamimidoylthiophen-2-yl)methylamino]-2-oxoethyl]-5-oxopyrrolidine-2-carboxamide Traditional Name: 2-(3-amidinobenzyl)-N-[2-[(5-amidino-2-thienyl)methylamino]-2-keto-ethyl]-5-keto-pyrrolidine-2-carboxamide Formula: C21H25N7O3S MolecularWeight: 455.5333

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1=O)(CC2=CC=CC(=C2)C(=N)N)C(=O)NCC(=O)NCC3=CC=C(S3)C(=N)N

Isomeric SMILES

C1CC(NC1=O)(CC2=CC=CC(=C2)C(=N)N)C(=O)NCC(=O)NCC3=CC=C(S3)C(=N)N

InChI

InChI=1S/C21H25N7O3S/c22-18(23)13-3-1-2-12(8-13)9-21(7-6-16(29)28-21)20(31)27-11-17(30)26-10-14-4-5-15(32-14)19(24)25/h1-5,8H,6-7,9-11H2,(H3,22,23)(H3,24,25)(H,26,30)(H,27,31)(H,28,29)