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

Systemtic Name: methyl 2-[[2-(4-carbamimidoylphenyl)carbonylimino-3,4-dimethyl-1,3-thiazol-5-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[2-(4-carbamimidoylbenzoyl)imino-3,4-dimethyl-thiazole-5-carbonyl]amino]acetate CAS Name: 2-[[[2-[(4-carbamimidoylphenyl)-oxomethyl]imino-3,4-dimethyl-5-thiazolyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(4-carbamimidoylbenzoyl)imino-3,4-dimethyl-1,3-thiazole-5-carbonyl]amino]acetate Traditional Name: 2-[[2-(4-amidinobenzoyl)imino-3,4-dimethyl-4-thiazoline-5-carbonyl]amino]acetic acid methyl ester Formula: C17H19N5O4S MolecularWeight: 389.42886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=NC(=O)C2=CC=C(C=C2)C(=N)N)N1C)C(=O)NCC(=O)OC

Isomeric SMILES

CC1=C(SC(=NC(=O)C2=CC=C(C=C2)C(=N)N)N1C)C(=O)NCC(=O)OC

InChI

InChI=1S/C17H19N5O4S/c1-9-13(16(25)20-8-12(23)26-3)27-17(22(9)2)21-15(24)11-6-4-10(5-7-11)14(18)19/h4-7H,8H2,1-3H3,(H3,18,19)(H,20,25)