N-butyl-4-isothiocyanato-1-oxidanyl-naphthalene-2-carboxamide

Systemtic Name: N-butyl-4-isothiocyanato-1-oxidanyl-naphthalene-2-carboxamide Openeye Name: N-butyl-1-hydroxy-4-isothiocyanato-naphthalene-2-carboxamide CAS Name: N-butyl-1-hydroxy-4-isothiocyanato-2-naphthalenecarboxamide IUPAC Name: N-butyl-1-hydroxy-4-isothiocyanatonaphthalene-2-carboxamide Traditional Name: N-butyl-1-hydroxy-4-isothiocyanato-2-naphthamide Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(C2=CC=CC=C2C(=C1)N=C=S)O

Isomeric SMILES

CCCCNC(=O)C1=C(C2=CC=CC=C2C(=C1)N=C=S)O

InChI

InChI=1S/C16H16N2O2S/c1-2-3-8-17-16(20)13-9-14(18-10-21)11-6-4-5-7-12(11)15(13)19/h4-7,9,19H,2-3,8H2,1H3,(H,17,20)