3-[3-[4-(5-carbamimidoyl-1,3-thiazol-2-yl)phenyl]-1-methanoyl-2-oxidanylidene-pyrrolidin-3-yl]propanoic acid

Systemtic Name: 3-[3-[4-(5-carbamimidoyl-1,3-thiazol-2-yl)phenyl]-1-methanoyl-2-oxidanylidene-pyrrolidin-3-yl]propanoic acid Openeye Name: 3-[3-[4-(5-carbamimidoylthiazol-2-yl)phenyl]-1-formyl-2-oxo-pyrrolidin-3-yl]propanoic acid CAS Name: 3-[3-[4-(5-carbamimidoyl-2-thiazolyl)phenyl]-1-formyl-2-oxo-3-pyrrolidinyl]propanoic acid IUPAC Name: 3-[3-[4-(5-carbamimidoyl-1,3-thiazol-2-yl)phenyl]-1-formyl-2-oxopyrrolidin-3-yl]propanoic acid Traditional Name: 3-[3-[4-(5-amidinothiazol-2-yl)phenyl]-1-formyl-2-keto-pyrrolidin-3-yl]propionic acid Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1(CCC(=O)O)C2=CC=C(C=C2)C3=NC=C(S3)C(=N)N)C=O

Isomeric SMILES

C1CN(C(=O)C1(CCC(=O)O)C2=CC=C(C=C2)C3=NC=C(S3)C(=N)N)C=O

InChI

InChI=1S/C18H18N4O4S/c19-15(20)13-9-21-16(27-13)11-1-3-12(4-2-11)18(6-5-14(24)25)7-8-22(10-23)17(18)26/h1-4,9-10H,5-8H2,(H3,19,20)(H,24,25)