3-(3-azanylthiophen-2-yl)propanoyl 5-(4-carbamimidoylphenyl)pentanoate

Systemtic Name: 3-(3-azanylthiophen-2-yl)propanoyl 5-(4-carbamimidoylphenyl)pentanoate Openeye Name: 3-(3-amino-2-thienyl)propanoyl 5-(4-carbamimidoylphenyl)pentanoate CAS Name: 5-(4-carbamimidoylphenyl)pentanoic acid [3-(3-amino-2-thiophenyl)-1-oxopropyl] ester IUPAC Name: 3-(3-aminothiophen-2-yl)propanoyl 5-(4-carbamimidoylphenyl)pentanoate Traditional Name: 5-(4-amidinophenyl)valeric acid 3-(3-amino-2-thienyl)propanoyl ester Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCC(=O)OC(=O)CCC2=C(C=CS2)N)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1CCCCC(=O)OC(=O)CCC2=C(C=CS2)N)C(=N)N

InChI

InChI=1S/C19H23N3O3S/c20-15-11-12-26-16(15)9-10-18(24)25-17(23)4-2-1-3-13-5-7-14(8-6-13)19(21)22/h5-8,11-12H,1-4,9-10,20H2,(H3,21,22)