S-methyl 5-ethyl-5-(2-methylpropyl)-2-naphthalen-1-ylimino-1,3-thiazinane-3-carbothioate

Systemtic Name: S-methyl 5-ethyl-5-(2-methylpropyl)-2-naphthalen-1-ylimino-1,3-thiazinane-3-carbothioate Openeye Name: S-methyl 5-ethyl-5-isobutyl-2-(1-naphthylimino)-1,3-thiazinane-3-carbothioate CAS Name: 5-ethyl-5-(2-methylpropyl)-2-(1-naphthalenylimino)-1,3-thiazinane-3-carbothioic acid S-methyl ester IUPAC Name: S-methyl 5-ethyl-5-(2-methylpropyl)-2-naphthalen-1-ylimino-1,3-thiazinane-3-carbothioate Traditional Name: 5-ethyl-5-isobutyl-2-(1-naphthylimino)-1,3-thiazinane-3-carbothioic acid S-methyl ester Formula: C22H28N2OS2 MolecularWeight: 400.60052

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CN(C(=NC2=CC=CC3=CC=CC=C32)SC1)C(=O)SC)CC(C)C

Isomeric SMILES

CCC1(CN(C(=NC2=CC=CC3=CC=CC=C32)SC1)C(=O)SC)CC(C)C

InChI

InChI=1S/C22H28N2OS2/c1-5-22(13-16(2)3)14-24(21(25)26-4)20(27-15-22)23-19-12-8-10-17-9-6-7-11-18(17)19/h6-12,16H,5,13-15H2,1-4H3