N-(4-butylphenyl)-3-oxidanylidene-1,4-benzothiazine-4-carbothioamide

Systemtic Name: N-(4-butylphenyl)-3-oxidanylidene-1,4-benzothiazine-4-carbothioamide Openeye Name: N-(4-butylphenyl)-3-oxo-1,4-benzothiazine-4-carbothioamide CAS Name: N-(4-butylphenyl)-3-oxo-1,4-benzothiazine-4-carbothioamide IUPAC Name: N-(4-butylphenyl)-3-oxo-1,4-benzothiazine-4-carbothioamide Traditional Name: N-(4-butylphenyl)-3-keto-1,4-benzothiazine-4-carbothioamide Formula: C19H20N2OS2 MolecularWeight: 356.5049

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C19H20N2OS2/c1-2-3-6-14-9-11-15(12-10-14)20-19(23)21-16-7-4-5-8-17(16)24-13-18(21)22/h4-5,7-12H,2-3,6,13H2,1H3,(H,20,23)