N-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-cyclohexyl-carbamothioyl]-5-bromanyl-naphthalene-1-carboxamide

Systemtic Name: N-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-cyclohexyl-carbamothioyl]-5-bromanyl-naphthalene-1-carboxamide Openeye Name: N-[[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methyl-cyclohexyl-carbamothioyl]-5-bromo-naphthalene-1-carboxamide CAS Name: N-[[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-cyclohexylamino]-sulfanylidenemethyl]-5-bromo-1-naphthalenecarboxamide IUPAC Name: N-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-cyclohexylcarbamothioyl]-5-bromonaphthalene-1-carboxamide Traditional Name: N-[[4-(2-amino-2-keto-ethoxy)-3-methoxy-benzyl]-cyclohexyl-thiocarbamoyl]-5-bromo-1-naphthamide Formula: C28H30BrN3O4S MolecularWeight: 584.5245

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN(C2CCCCC2)C(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Br)OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)CN(C2CCCCC2)C(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Br)OCC(=O)N

InChI

InChI=1S/C28H30BrN3O4S/c1-35-25-15-18(13-14-24(25)36-17-26(30)33)16-32(19-7-3-2-4-8-19)28(37)31-27(34)22-11-5-10-21-20(22)9-6-12-23(21)29/h5-6,9-15,19H,2-4,7-8,16-17H2,1H3,(H2,30,33)(H,31,34,37)