N-[2-(2,4-dichlorophenyl)pentyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[2-(2,4-dichlorophenyl)pentyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanamide Openeye Name: N-[2-(2,4-dichlorophenyl)pentyl]-2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetamide CAS Name: N-[2-(2,4-dichlorophenyl)pentyl]-2-[(4-oxo-1H-quinazolin-2-yl)thio]acetamide IUPAC Name: N-[2-(2,4-dichlorophenyl)pentyl]-2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetamide Traditional Name: N-[2-(2,4-dichlorophenyl)pentyl]-2-[(4-keto-1H-quinazolin-2-yl)thio]acetamide Formula: C21H21Cl2N3O2S MolecularWeight: 450.38134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CNC(=O)CSC1=NC(=O)C2=CC=CC=C2N1)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCC(CNC(=O)CSC1=NC(=O)C2=CC=CC=C2N1)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H21Cl2N3O2S/c1-2-5-13(15-9-8-14(22)10-17(15)23)11-24-19(27)12-29-21-25-18-7-4-3-6-16(18)20(28)26-21/h3-4,6-10,13H,2,5,11-12H2,1H3,(H,24,27)(H,25,26,28)