7-methyl-3-oxidanylidene-N-phenethyl-1,4-benzothiazine-4-carbothioamide

Systemtic Name: 7-methyl-3-oxidanylidene-N-phenethyl-1,4-benzothiazine-4-carbothioamide Openeye Name: 7-methyl-3-oxo-N-phenethyl-1,4-benzothiazine-4-carbothioamide CAS Name: 7-methyl-3-oxo-N-phenethyl-1,4-benzothiazine-4-carbothioamide IUPAC Name: 7-methyl-3-oxo-N-phenethyl-1,4-benzothiazine-4-carbothioamide Traditional Name: 3-keto-7-methyl-N-phenethyl-1,4-benzothiazine-4-carbothioamide Formula: C18H18N2OS2 MolecularWeight: 342.47832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)CS2)C(=S)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)CS2)C(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C18H18N2OS2/c1-13-7-8-15-16(11-13)23-12-17(21)20(15)18(22)19-10-9-14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H,19,22)