N-(4-butylphenyl)-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine

Systemtic Name: N-(4-butylphenyl)-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine Openeye Name: N-(4-butylphenyl)-1,1-dioxo-1,2-benzothiazol-3-amine CAS Name: N-(4-butylphenyl)-1,1-dioxo-1,2-benzothiazol-3-amine IUPAC Name: N-(4-butylphenyl)-1,1-dioxo-1,2-benzothiazol-3-amine Traditional Name: (4-butylphenyl)-(1,1-diketo-1,2-benzothiazol-3-yl)amine Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C17H18N2O2S/c1-2-3-6-13-9-11-14(12-10-13)18-17-15-7-4-5-8-16(15)22(20,21)19-17/h4-5,7-12H,2-3,6H2,1H3,(H,18,19)