ethyl 2-[(5-bromanylnaphthalen-1-yl)carbonylcarbamothioylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(5-bromanylnaphthalen-1-yl)carbonylcarbamothioylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(5-bromonaphthalene-1-carbonyl)carbamothioylamino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[[[(5-bromo-1-naphthalenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-bromonaphthalene-1-carbonyl)carbamothioylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(5-bromo-1-naphthoyl)thiocarbamoylamino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C19H16BrN3O3S2 MolecularWeight: 478.38264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=S)NC(=O)C2=CC=CC3=C2C=CC=C3Br)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=S)NC(=O)C2=CC=CC3=C2C=CC=C3Br)C

InChI

InChI=1S/C19H16BrN3O3S2/c1-3-26-17(25)15-10(2)21-19(28-15)23-18(27)22-16(24)13-8-4-7-12-11(13)6-5-9-14(12)20/h4-9H,3H2,1-2H3,(H2,21,22,23,24,27)