ethyl 3-(4-carbamimidoylphenyl)-2-[3-(naphthalen-2-ylsulfonylamino)-2-oxidanylidene-pyrrolidin-1-yl]propanoate

Systemtic Name: ethyl 3-(4-carbamimidoylphenyl)-2-[3-(naphthalen-2-ylsulfonylamino)-2-oxidanylidene-pyrrolidin-1-yl]propanoate Openeye Name: ethyl 3-(4-carbamimidoylphenyl)-2-[3-(2-naphthylsulfonylamino)-2-oxo-pyrrolidin-1-yl]propanoate CAS Name: 3-(4-carbamimidoylphenyl)-2-[3-(2-naphthalenylsulfonylamino)-2-oxo-1-pyrrolidinyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-carbamimidoylphenyl)-2-[3-(naphthalen-2-ylsulfonylamino)-2-oxopyrrolidin-1-yl]propanoate Traditional Name: 3-(4-amidinophenyl)-2-[2-keto-3-(2-naphthylsulfonylamino)pyrrolidino]propionic acid ethyl ester Formula: C26H28N4O5S MolecularWeight: 508.58932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)C(=N)N)N2CCC(C2=O)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)C(=N)N)N2CCC(C2=O)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H28N4O5S/c1-2-35-26(32)23(15-17-7-9-19(10-8-17)24(27)28)30-14-13-22(25(30)31)29-36(33,34)21-12-11-18-5-3-4-6-20(18)16-21/h3-12,16,22-23,29H,2,13-15H2,1H3,(H3,27,28)