N-(2-butylsulfanyl-1,3-benzothiazol-6-yl)naphthalene-1-carboxamide

Systemtic Name: N-(2-butylsulfanyl-1,3-benzothiazol-6-yl)naphthalene-1-carboxamide Openeye Name: N-(2-butylsulfanyl-1,3-benzothiazol-6-yl)naphthalene-1-carboxamide CAS Name: N-[2-(butylthio)-1,3-benzothiazol-6-yl]-1-naphthalenecarboxamide IUPAC Name: N-(2-butylsulfanyl-1,3-benzothiazol-6-yl)naphthalene-1-carboxamide Traditional Name: N-[2-(butylthio)-1,3-benzothiazol-6-yl]-1-naphthamide Formula: C22H20N2OS2 MolecularWeight: 392.537

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H20N2OS2/c1-2-3-13-26-22-24-19-12-11-16(14-20(19)27-22)23-21(25)18-10-6-8-15-7-4-5-9-17(15)18/h4-12,14H,2-3,13H2,1H3,(H,23,25)