2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-ethyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-ethyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(7-chloro-3-isopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-ethyl-acetamide CAS Name: 2-[[7-chloro-3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]-N-ethyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[7-chloro-3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanyl-N-ethylacetamide Traditional Name: N-benzyl-2-[(7-chloro-3-isoamyl-4-keto-quinazolin-2-yl)thio]-N-ethyl-acetamide Formula: C24H28ClN3O2S MolecularWeight: 458.01602

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCC(C)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCC(C)C

InChI

InChI=1S/C24H28ClN3O2S/c1-4-27(15-18-8-6-5-7-9-18)22(29)16-31-24-26-21-14-19(25)10-11-20(21)23(30)28(24)13-12-17(2)3/h5-11,14,17H,4,12-13,15-16H2,1-3H3