S-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)] N-(6-aminocarbonyl-5-oxidanyl-naphthalen-1-yl)-N-octyl-carbamothioate

Systemtic Name: S-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)] N-(6-aminocarbonyl-5-oxidanyl-naphthalen-1-yl)-N-octyl-carbamothioate Openeye Name: S-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)] N-(6-carbamoyl-5-hydroxy-1-naphthyl)-N-octyl-carbamothioate CAS Name: N-(6-carbamoyl-5-hydroxy-1-naphthalenyl)-N-octylcarbamothioic acid S-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]] ester IUPAC Name: S-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)] N-(6-carbamoyl-5-hydroxynaphthalen-1-yl)-N-octylcarbamothioate Traditional Name: N-(6-carbamoyl-5-hydroxy-1-naphthyl)-N-octyl-thiocarbamic acid S-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]] ester Formula: C23H28N4O3S3 MolecularWeight: 504.68842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(C1=CC=CC2=C1C=CC(=C2O)C(=O)N)C(=O)SC3=NN=C(S3)SC

Isomeric SMILES

CCCCCCCCN(C1=CC=CC2=C1C=CC(=C2O)C(=O)N)C(=O)SC3=NN=C(S3)SC

InChI

InChI=1S/C23H28N4O3S3/c1-3-4-5-6-7-8-14-27(23(30)33-22-26-25-21(31-2)32-22)18-11-9-10-16-15(18)12-13-17(19(16)28)20(24)29/h9-13,28H,3-8,14H2,1-2H3,(H2,24,29)