N-(2-chloranyl-4,6-dimethyl-phenyl)-2-[3-(2-dimethylaminoethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-2-[3-(2-dimethylaminoethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-[3-(2-dimethylaminoethyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-2-[[3-(2-dimethylaminoethyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-2-[3-(2-dimethylaminoethyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-[[3-(2-dimethylaminoethyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C22H25ClN4O2S MolecularWeight: 444.9775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCN(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCN(C)C)C

InChI

InChI=1S/C22H25ClN4O2S/c1-14-11-15(2)20(17(23)12-14)25-19(28)13-30-22-24-18-8-6-5-7-16(18)21(29)27(22)10-9-26(3)4/h5-8,11-12H,9-10,13H2,1-4H3,(H,25,28)