3-(5-bromanyl-2-phenylmethoxy-phenyl)-2-cyano-prop-2-enethioamide

Systemtic Name: 3-(5-bromanyl-2-phenylmethoxy-phenyl)-2-cyano-prop-2-enethioamide Openeye Name: 3-(2-benzyloxy-5-bromo-phenyl)-2-cyano-prop-2-enethioamide CAS Name: 3-(5-bromo-2-phenylmethoxyphenyl)-2-cyano-2-propenethioamide IUPAC Name: 3-(5-bromo-2-phenylmethoxyphenyl)-2-cyanoprop-2-enethioamide Traditional Name: 3-(2-benzoxy-5-bromo-phenyl)-2-cyano-thioacrylamide Formula: C17H13BrN2OS MolecularWeight: 373.26692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C=C(C#N)C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C=C(C#N)C(=S)N

InChI

InChI=1S/C17H13BrN2OS/c18-15-6-7-16(21-11-12-4-2-1-3-5-12)13(9-15)8-14(10-19)17(20)22/h1-9H,11H2,(H2,20,22)