4-bromanyl-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: 4-bromanyl-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-methoxy-naphthalene-2-carboxamide Openeye Name: 4-bromo-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-methoxy-naphthalene-2-carboxamide CAS Name: 4-bromo-N-[(1,2-dihydroacenaphthylen-5-ylamino)-sulfanylidenemethyl]-3-methoxy-2-naphthalenecarboxamide IUPAC Name: 4-bromo-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3-methoxynaphthalene-2-carboxamide Traditional Name: N-(acenaphthen-5-ylthiocarbamoyl)-4-bromo-3-methoxy-2-naphthamide Formula: C25H19BrN2O2S MolecularWeight: 491.39956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1C(=O)NC(=S)NC3=C4C=CC=C5C4=C(CC5)C=C3)Br

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1C(=O)NC(=S)NC3=C4C=CC=C5C4=C(CC5)C=C3)Br

InChI

InChI=1S/C25H19BrN2O2S/c1-30-23-19(13-16-5-2-3-7-17(16)22(23)26)24(29)28-25(31)27-20-12-11-15-10-9-14-6-4-8-18(20)21(14)15/h2-8,11-13H,9-10H2,1H3,(H2,27,28,29,31)