[2-[(5-bromanylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] 2-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: [2-[(5-bromanylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] 2-[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: [2-[(5-bromo-2-pyridyl)amino]-2-oxo-ethyl] 2-[2-(1-naphthylamino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(1-naphthalenylamino)-2-oxoethyl]thio]acetic acid [2-[(5-bromo-2-pyridinyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-bromopyridin-2-yl)amino]-2-oxoethyl] 2-[2-(naphthalen-1-ylamino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(1-naphthylamino)ethyl]thio]acetic acid [2-[(5-bromo-2-pyridyl)amino]-2-keto-ethyl] ester Formula: C21H18BrN3O4S MolecularWeight: 488.35432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=O)CSCC(=O)OCC(=O)NC3=NC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=O)CSCC(=O)OCC(=O)NC3=NC=C(C=C3)Br

InChI

InChI=1S/C21H18BrN3O4S/c22-15-8-9-18(23-10-15)25-19(26)11-29-21(28)13-30-12-20(27)24-17-7-3-5-14-4-1-2-6-16(14)17/h1-10H,11-13H2,(H,24,27)(H,23,25,26)