4-bromanyl-N-[(2-cyanophenyl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: 4-bromanyl-N-[(2-cyanophenyl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide Openeye Name: 4-bromo-N-[(2-cyanophenyl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide CAS Name: 4-bromo-N-[(2-cyanoanilino)-sulfanylidenemethyl]-3-methoxy-2-naphthalenecarboxamide IUPAC Name: 4-bromo-N-[(2-cyanophenyl)carbamothioyl]-3-methoxynaphthalene-2-carboxamide Traditional Name: 4-bromo-N-[(2-cyanophenyl)thiocarbamoyl]-3-methoxy-2-naphthamide Formula: C20H14BrN3O2S MolecularWeight: 440.31306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1C(=O)NC(=S)NC3=CC=CC=C3C#N)Br

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1C(=O)NC(=S)NC3=CC=CC=C3C#N)Br

InChI

InChI=1S/C20H14BrN3O2S/c1-26-18-15(10-12-6-2-4-8-14(12)17(18)21)19(25)24-20(27)23-16-9-5-3-7-13(16)11-22/h2-10H,1H3,(H2,23,24,25,27)