4-[2-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-N-(oxolan-2-ylmethyl)butanamide

Systemtic Name: 4-[2-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-N-(oxolan-2-ylmethyl)butanamide Openeye Name: 4-[4-oxo-2-[2-oxo-2-(sec-butylamino)ethyl]sulfanyl-quinazolin-3-yl]-N-(tetrahydrofuran-2-ylmethyl)butanamide CAS Name: 4-[2-[[2-(butan-2-ylamino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]-N-(2-oxolanylmethyl)butanamide IUPAC Name: 4-[2-[2-(butan-2-ylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]-N-(oxolan-2-ylmethyl)butanamide Traditional Name: 4-[4-keto-2-[[2-keto-2-(sec-butylamino)ethyl]thio]quinazolin-3-yl]-N-(tetrahydrofurfuryl)butyramide Formula: C23H32N4O4S MolecularWeight: 460.58958

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)NCC3CCCO3

Isomeric SMILES

CCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)NCC3CCCO3

InChI

InChI=1S/C23H32N4O4S/c1-3-16(2)25-21(29)15-32-23-26-19-10-5-4-9-18(19)22(30)27(23)12-6-11-20(28)24-14-17-8-7-13-31-17/h4-5,9-10,16-17H,3,6-8,11-15H2,1-2H3,(H,24,28)(H,25,29)