N-(cyclooctylideneamino)-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(cyclooctylideneamino)-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-(cyclooctylideneamino)-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-(cyclooctylideneamino)-4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]benzamide IUPAC Name: N-(cyclooctylideneamino)-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-(cyclooctylideneamino)-4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzamide Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NN=C3CCCCCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NN=C3CCCCCCC3)C

InChI

InChI=1S/C22H28N4OS/c1-16-14-17(2)24-22(23-16)28-15-18-10-12-19(13-11-18)21(27)26-25-20-8-6-4-3-5-7-9-20/h10-14H,3-9,15H2,1-2H3,(H,26,27)