N-[(5-chloranylthiophen-2-yl)methyl]-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-methyl-ethanamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-methyl-ethanamide Openeye Name: N-[(5-chloro-2-thienyl)methyl]-2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-methyl-acetamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-methylacetamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-methylacetamide Traditional Name: N-[(5-chloro-2-thienyl)methyl]-2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-methyl-acetamide Formula: C21H22ClN3O2S2 MolecularWeight: 448.00128

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(S1)Cl)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

Isomeric SMILES

CN(CC1=CC=C(S1)Cl)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

InChI

InChI=1S/C21H22ClN3O2S2/c1-24(12-15-10-11-18(22)29-15)19(26)13-28-21-23-17-9-5-4-8-16(17)20(27)25(21)14-6-2-3-7-14/h4-5,8-11,14H,2-3,6-7,12-13H2,1H3