methyl 3-[[2-(4-carbamimidoylphenyl)carbonylimino-4-methyl-3-phenyl-1,3-thiazol-5-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-[[2-(4-carbamimidoylphenyl)carbonylimino-4-methyl-3-phenyl-1,3-thiazol-5-yl]carbonylamino]propanoate Openeye Name: methyl 3-[[2-(4-carbamimidoylbenzoyl)imino-4-methyl-3-phenyl-thiazole-5-carbonyl]amino]propanoate CAS Name: 3-[[[2-[(4-carbamimidoylphenyl)-oxomethyl]imino-4-methyl-3-phenyl-5-thiazolyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-carbamimidoylbenzoyl)imino-4-methyl-3-phenyl-1,3-thiazole-5-carbonyl]amino]propanoate Traditional Name: 3-[[2-(4-amidinobenzoyl)imino-4-methyl-3-phenyl-4-thiazoline-5-carbonyl]amino]propionic acid methyl ester Formula: C23H23N5O4S MolecularWeight: 465.52482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=NC(=O)C2=CC=C(C=C2)C(=N)N)N1C3=CC=CC=C3)C(=O)NCCC(=O)OC

Isomeric SMILES

CC1=C(SC(=NC(=O)C2=CC=C(C=C2)C(=N)N)N1C3=CC=CC=C3)C(=O)NCCC(=O)OC

InChI

InChI=1S/C23H23N5O4S/c1-14-19(22(31)26-13-12-18(29)32-2)33-23(28(14)17-6-4-3-5-7-17)27-21(30)16-10-8-15(9-11-16)20(24)25/h3-11H,12-13H2,1-2H3,(H3,24,25)(H,26,31)