3-(3-chloranyl-5-ethoxy-4-phenylmethoxy-phenyl)-2-cyano-prop-2-enethioamide

Systemtic Name: 3-(3-chloranyl-5-ethoxy-4-phenylmethoxy-phenyl)-2-cyano-prop-2-enethioamide Openeye Name: 3-(4-benzyloxy-3-chloro-5-ethoxy-phenyl)-2-cyano-prop-2-enethioamide CAS Name: 3-(3-chloro-5-ethoxy-4-phenylmethoxyphenyl)-2-cyano-2-propenethioamide IUPAC Name: 3-(3-chloro-5-ethoxy-4-phenylmethoxyphenyl)-2-cyanoprop-2-enethioamide Traditional Name: 3-(4-benzoxy-3-chloro-5-ethoxy-phenyl)-2-cyano-thioacrylamide Formula: C19H17ClN2O2S MolecularWeight: 372.86848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=S)N)Cl)OCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C(C#N)C(=S)N)Cl)OCC2=CC=CC=C2

InChI

InChI=1S/C19H17ClN2O2S/c1-2-23-17-10-14(8-15(11-21)19(22)25)9-16(20)18(17)24-12-13-6-4-3-5-7-13/h3-10H,2,12H2,1H3,(H2,22,25)