ethyl 2-[[3-chloranyl-4-(quinolin-2-ylmethoxy)phenyl]-methyl-amino]-2-sulfanylidene-ethanoate

Systemtic Name: ethyl 2-[[3-chloranyl-4-(quinolin-2-ylmethoxy)phenyl]-methyl-amino]-2-sulfanylidene-ethanoate Openeye Name: ethyl 2-[3-chloro-N-methyl-4-(2-quinolylmethoxy)anilino]-2-thioxo-acetate CAS Name: 2-[3-chloro-N-methyl-4-(2-quinolinylmethoxy)anilino]-2-sulfanylideneacetic acid ethyl ester IUPAC Name: ethyl 2-[3-chloro-N-methyl-4-(quinolin-2-ylmethoxy)anilino]-2-sulfanylideneacetate Traditional Name: 2-[3-chloro-N-methyl-4-(2-quinolylmethoxy)anilino]-2-thioxo-acetic acid ethyl ester Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=S)N(C)C1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)Cl

Isomeric SMILES

CCOC(=O)C(=S)N(C)C1=CC(=C(C=C1)OCC2=NC3=CC=CC=C3C=C2)Cl

InChI

InChI=1S/C21H19ClN2O3S/c1-3-26-21(25)20(28)24(2)16-10-11-19(17(22)12-16)27-13-15-9-8-14-6-4-5-7-18(14)23-15/h4-12H,3,13H2,1-2H3