[1-(4-carbamimidoylphenyl)-3-ethyl-2-oxidanylidene-pyrrolidin-3-yl] (E)-5-(aminocarbonylamino)pent-4-enoate

Systemtic Name: [1-(4-carbamimidoylphenyl)-3-ethyl-2-oxidanylidene-pyrrolidin-3-yl] (E)-5-(aminocarbonylamino)pent-4-enoate Openeye Name: [1-(4-carbamimidoylphenyl)-3-ethyl-2-oxo-pyrrolidin-3-yl] (E)-5-ureidopent-4-enoate CAS Name: (E)-5-(carbamoylamino)-4-pentenoic acid [1-(4-carbamimidoylphenyl)-3-ethyl-2-oxo-3-pyrrolidinyl] ester IUPAC Name: [1-(4-carbamimidoylphenyl)-3-ethyl-2-oxopyrrolidin-3-yl] (E)-5-(carbamoylamino)pent-4-enoate Traditional Name: (E)-5-ureidopent-4-enoic acid [1-(4-amidinophenyl)-3-ethyl-2-keto-pyrrolidin-3-yl] ester Formula: C19H25N5O4 MolecularWeight: 387.4329

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCN(C1=O)C2=CC=C(C=C2)C(=N)N)OC(=O)CCC=CNC(=O)N

Isomeric SMILES

CCC1(CCN(C1=O)C2=CC=C(C=C2)C(=N)N)OC(=O)CC/C=C/NC(=O)N

InChI

InChI=1S/C19H25N5O4/c1-2-19(28-15(25)5-3-4-11-23-18(22)27)10-12-24(17(19)26)14-8-6-13(7-9-14)16(20)21/h4,6-9,11H,2-3,5,10,12H2,1H3,(H3,20,21)(H3,22,23,27)/b11-4+