N-(2-azanylethyl)-2-[3-[2-(5-carbamimidoyl-2-methylsulfanyl-thiophen-3-yl)-1,3-thiazol-4-yl]phenoxy]ethanamide

Systemtic Name: N-(2-azanylethyl)-2-[3-[2-(5-carbamimidoyl-2-methylsulfanyl-thiophen-3-yl)-1,3-thiazol-4-yl]phenoxy]ethanamide Openeye Name: N-(2-aminoethyl)-2-[3-[2-(5-carbamimidoyl-2-methylsulfanyl-3-thienyl)thiazol-4-yl]phenoxy]acetamide CAS Name: N-(2-aminoethyl)-2-[3-[2-[5-carbamimidoyl-2-(methylthio)-3-thiophenyl]-4-thiazolyl]phenoxy]acetamide IUPAC Name: N-(2-aminoethyl)-2-[3-[2-(5-carbamimidoyl-2-methylsulfanylthiophen-3-yl)-1,3-thiazol-4-yl]phenoxy]acetamide Traditional Name: 2-[3-[2-[5-amidino-2-(methylthio)-3-thienyl]thiazol-4-yl]phenoxy]-N-(2-aminoethyl)acetamide Formula: C19H21N5O2S3 MolecularWeight: 447.59734

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(S1)C(=N)N)C2=NC(=CS2)C3=CC(=CC=C3)OCC(=O)NCCN

Isomeric SMILES

CSC1=C(C=C(S1)C(=N)N)C2=NC(=CS2)C3=CC(=CC=C3)OCC(=O)NCCN

InChI

InChI=1S/C19H21N5O2S3/c1-27-19-13(8-15(29-19)17(21)22)18-24-14(10-28-18)11-3-2-4-12(7-11)26-9-16(25)23-6-5-20/h2-4,7-8,10H,5-6,9,20H2,1H3,(H3,21,22)(H,23,25)