N-[6,6-dimethyl-4-oxidanylidene-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazinan-5-yl]-4-nitro-benzamide

Systemtic Name: N-[6,6-dimethyl-4-oxidanylidene-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazinan-5-yl]-4-nitro-benzamide Openeye Name: N-(3-benzyl-6,6-dimethyl-4-oxo-2-thioxo-1,3-thiazinan-5-yl)-4-nitro-benzamide CAS Name: N-[6,6-dimethyl-4-oxo-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazinan-5-yl]-4-nitrobenzamide IUPAC Name: N-(3-benzyl-6,6-dimethyl-4-oxo-2-sulfanylidene-1,3-thiazinan-5-yl)-4-nitrobenzamide Traditional Name: N-(3-benzyl-4-keto-6,6-dimethyl-2-thioxo-1,3-thiazinan-5-yl)-4-nitro-benzamide Formula: C20H19N3O4S2 MolecularWeight: 429.51256

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)N(C(=S)S1)CC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1(C(C(=O)N(C(=S)S1)CC2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H19N3O4S2/c1-20(2)16(21-17(24)14-8-10-15(11-9-14)23(26)27)18(25)22(19(28)29-20)12-13-6-4-3-5-7-13/h3-11,16H,12H2,1-2H3,(H,21,24)