N-[2-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[2-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-4-fluoranyl-benzamide Openeye Name: N-[2-[2-(cyclohexylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]-4-fluoro-benzamide CAS Name: N-[2-[[2-(cyclohexylamino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]-4-fluorobenzamide IUPAC Name: N-[2-[2-(cyclohexylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]-4-fluorobenzamide Traditional Name: N-[2-[[2-(cyclohexylamino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]-4-fluoro-benzamide Formula: C23H23FN4O3S MolecularWeight: 454.517123

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(CC1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN4O3S/c24-16-12-10-15(11-13-16)21(30)27-28-22(31)18-8-4-5-9-19(18)26-23(28)32-14-20(29)25-17-6-2-1-3-7-17/h4-5,8-13,17H,1-3,6-7,14H2,(H,25,29)(H,27,30)