1-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethylidene]-3,3-dimethyl-2,4-dihydroisoquinoline

Systemtic Name: 1-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethylidene]-3,3-dimethyl-2,4-dihydroisoquinoline Openeye Name: 1-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethylene]-3,3-dimethyl-2,4-dihydroisoquinoline CAS Name: 1-[[(4,6-dimethyl-2-pyrimidinyl)thio]methylidene]-3,3-dimethyl-2,4-dihydroisoquinoline IUPAC Name: 1-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethylidene]-3,3-dimethyl-2,4-dihydroisoquinoline Traditional Name: 1-[[(4,6-dimethylpyrimidin-2-yl)thio]methylene]-3,3-dimethyl-2,4-dihydroisoquinoline Formula: C18H21N3S MolecularWeight: 311.44444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC=C2C3=CC=CC=C3CC(N2)(C)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC=C2C3=CC=CC=C3CC(N2)(C)C)C

InChI

InChI=1S/C18H21N3S/c1-12-9-13(2)20-17(19-12)22-11-16-15-8-6-5-7-14(15)10-18(3,4)21-16/h5-9,11,21H,10H2,1-4H3