3-[(4-methylphenyl)methoxy]-5-[2-(propan-2-ylamino)ethylcarbamoylamino]-1,2-thiazole-4-carboxylic acid

Systemtic Name: 3-[(4-methylphenyl)methoxy]-5-[2-(propan-2-ylamino)ethylcarbamoylamino]-1,2-thiazole-4-carboxylic acid Openeye Name: 5-[2-(isopropylamino)ethylcarbamoylamino]-3-(p-tolylmethoxy)isothiazole-4-carboxylic acid CAS Name: 3-[(4-methylphenyl)methoxy]-5-[[oxo-[2-(propan-2-ylamino)ethylamino]methyl]amino]-4-isothiazolecarboxylic acid IUPAC Name: 3-[(4-methylphenyl)methoxy]-5-[2-(propan-2-ylamino)ethylcarbamoylamino]-1,2-thiazole-4-carboxylic acid Traditional Name: 5-[2-(isopropylamino)ethylcarbamoylamino]-3-(4-methylbenzyl)oxy-isothiazole-4-carboxylic acid Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=NSC(=C2C(=O)O)NC(=O)NCCNC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)COC2=NSC(=C2C(=O)O)NC(=O)NCCNC(C)C

InChI

InChI=1S/C18H24N4O4S/c1-11(2)19-8-9-20-18(25)21-16-14(17(23)24)15(22-27-16)26-10-13-6-4-12(3)5-7-13/h4-7,11,19H,8-10H2,1-3H3,(H,23,24)(H2,20,21,25)