N-[[3-(pentanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: N-[[3-(pentanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide Openeye Name: N-[[3-(pentanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide CAS Name: N-[[3-(1-oxopentylamino)anilino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: N-[[3-(pentanoylamino)phenyl]carbamothioyl]naphthalene-1-carboxamide Traditional Name: N-[[3-(valerylamino)phenyl]thiocarbamoyl]-1-naphthamide Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C23H23N3O2S/c1-2-3-14-21(27)24-17-10-7-11-18(15-17)25-23(29)26-22(28)20-13-6-9-16-8-4-5-12-19(16)20/h4-13,15H,2-3,14H2,1H3,(H,24,27)(H2,25,26,28,29)