4-[3-(2,3-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N,N-diethyl-butanamide

Systemtic Name: 4-[3-(2,3-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N,N-diethyl-butanamide Openeye Name: 4-[3-(2,3-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N,N-diethyl-butanamide CAS Name: 4-[[3-(2,3-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-N,N-diethylbutanamide IUPAC Name: 4-[3-(2,3-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N,N-diethylbutanamide Traditional Name: 4-[[3-(2,3-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]-N,N-diethyl-butyramide Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC(=C3C)C

Isomeric SMILES

CCN(CC)C(=O)CCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC(=C3C)C

InChI

InChI=1S/C24H29N3O2S/c1-5-26(6-2)22(28)15-10-16-30-24-25-20-13-8-7-12-19(20)23(29)27(24)21-14-9-11-17(3)18(21)4/h7-9,11-14H,5-6,10,15-16H2,1-4H3