[2-[(5-bromanyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 8-azanylnaphthalene-1-carboxylate

Systemtic Name: [2-[(5-bromanyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 8-azanylnaphthalene-1-carboxylate Openeye Name: [2-[(5-bromothiazol-2-yl)amino]-2-oxo-ethyl] 8-aminonaphthalene-1-carboxylate CAS Name: 8-amino-1-naphthalenecarboxylic acid [2-[(5-bromo-2-thiazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-bromo-1,3-thiazol-2-yl)amino]-2-oxoethyl] 8-aminonaphthalene-1-carboxylate Traditional Name: 8-aminonaphthalene-1-carboxylic acid [2-[(5-bromothiazol-2-yl)amino]-2-keto-ethyl] ester Formula: C16H12BrN3O3S MolecularWeight: 406.25378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C(=O)OCC(=O)NC3=NC=C(S3)Br)C(=CC=C2)N

Isomeric SMILES

C1=CC2=C(C(=C1)C(=O)OCC(=O)NC3=NC=C(S3)Br)C(=CC=C2)N

InChI

InChI=1S/C16H12BrN3O3S/c17-12-7-19-16(24-12)20-13(21)8-23-15(22)10-5-1-3-9-4-2-6-11(18)14(9)10/h1-7H,8,18H2,(H,19,20,21)