N-[5,5-dimethyl-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-(4-nitrophenyl)methanimine oxide

Systemtic Name: N-[5,5-dimethyl-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-(4-nitrophenyl)methanimine oxide Openeye Name: N-(3-benzyl-5,5-dimethyl-2-thioxo-thiazolidin-4-yl)-1-(4-nitrophenyl)methanimine oxide CAS Name: N-[5,5-dimethyl-3-(phenylmethyl)-2-sulfanylidene-4-thiazolidinyl]-1-(4-nitrophenyl)methanimine oxide IUPAC Name: N-(3-benzyl-5,5-dimethyl-2-sulfanylidene-1,3-thiazolidin-4-yl)-1-(4-nitrophenyl)methanimine oxide Traditional Name: N-(3-benzyl-5,5-dimethyl-2-thioxo-thiazolidin-4-yl)-1-(4-nitrophenyl)methanimine oxide Formula: C19H19N3O3S2 MolecularWeight: 401.50246

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(C(=S)S1)CC2=CC=CC=C2)[N+](=CC3=CC=C(C=C3)[N+](=O)[O-])[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O3S2/c1-19(2)17(20(18(26)27-19)12-14-6-4-3-5-7-14)21(23)13-15-8-10-16(11-9-15)22(24)25/h3-11,13,17H,12H2,1-2H3/b21-13-