[2-[(6-bromanyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl] 5-methylpyrazine-2-carboxylate

Systemtic Name: [2-[(6-bromanyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl] 5-methylpyrazine-2-carboxylate Openeye Name: [2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl] 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid [2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid [2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl] ester Formula: C15H11BrN4O3S MolecularWeight: 407.24184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)Br

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)Br

InChI

InChI=1S/C15H11BrN4O3S/c1-8-5-18-11(6-17-8)14(22)23-7-13(21)20-15-19-10-3-2-9(16)4-12(10)24-15/h2-6H,7H2,1H3,(H,19,20,21)