2-[7-chloranyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-[(2-chlorophenyl)methyl]ethanamide

Systemtic Name: 2-[7-chloranyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-[(2-chlorophenyl)methyl]ethanamide Openeye Name: 2-[7-chloro-4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-[(2-chlorophenyl)methyl]acetamide CAS Name: 2-[[7-chloro-4-oxo-3-(2-oxolanylmethyl)-2-quinazolinyl]thio]-N-[(2-chlorophenyl)methyl]acetamide IUPAC Name: 2-[7-chloro-4-oxo-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-[(2-chlorophenyl)methyl]acetamide Traditional Name: N-(2-chlorobenzyl)-2-[[7-chloro-4-keto-3-(tetrahydrofurfuryl)quinazolin-2-yl]thio]acetamide Formula: C22H21Cl2N3O3S MolecularWeight: 478.39144

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NCC4=CC=CC=C4Cl

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C22H21Cl2N3O3S/c23-15-7-8-17-19(10-15)26-22(27(21(17)29)12-16-5-3-9-30-16)31-13-20(28)25-11-14-4-1-2-6-18(14)24/h1-2,4,6-8,10,16H,3,5,9,11-13H2,(H,25,28)