N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[3-(3,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[[3-(3,5-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[3-(3,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[[3-(3,5-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C27H24N4O2S2 MolecularWeight: 500.63506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=NC5=C(C=C(C=C5S4)C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=NC5=C(C=C(C=C5S4)C)C)C

InChI

InChI=1S/C27H24N4O2S2/c1-15-9-16(2)12-19(11-15)31-25(33)20-7-5-6-8-21(20)28-27(31)34-14-23(32)29-26-30-24-18(4)10-17(3)13-22(24)35-26/h5-13H,14H2,1-4H3,(H,29,30,32)