2-[5-[[4-(5-carbamimidoylthiophen-2-yl)phenoxy]methyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[5-[[4-(5-carbamimidoylthiophen-2-yl)phenoxy]methyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[5-[[4-(5-carbamimidoyl-2-thienyl)phenoxy]methyl]-2-oxo-pyrrolidin-3-yl]acetic acid CAS Name: 2-[5-[[4-(5-carbamimidoyl-2-thiophenyl)phenoxy]methyl]-2-oxo-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[5-[[4-(5-carbamimidoylthiophen-2-yl)phenoxy]methyl]-2-oxopyrrolidin-3-yl]acetic acid Traditional Name: 2-[5-[[4-(5-amidino-2-thienyl)phenoxy]methyl]-2-keto-pyrrolidin-3-yl]acetic acid Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)NC1COC2=CC=C(C=C2)C3=CC=C(S3)C(=N)N)CC(=O)O

Isomeric SMILES

C1C(C(=O)NC1COC2=CC=C(C=C2)C3=CC=C(S3)C(=N)N)CC(=O)O

InChI

InChI=1S/C18H19N3O4S/c19-17(20)15-6-5-14(26-15)10-1-3-13(4-2-10)25-9-12-7-11(8-16(22)23)18(24)21-12/h1-6,11-12H,7-9H2,(H3,19,20)(H,21,24)(H,22,23)