3-[2-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-N-cyclohexyl-propanamide

Systemtic Name: 3-[2-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-N-cyclohexyl-propanamide Openeye Name: N-cyclohexyl-3-[4-oxo-2-[2-oxo-2-(sec-butylamino)ethyl]sulfanyl-quinazolin-3-yl]propanamide CAS Name: 3-[2-[[2-(butan-2-ylamino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]-N-cyclohexylpropanamide IUPAC Name: 3-[2-[2-(butan-2-ylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]-N-cyclohexylpropanamide Traditional Name: N-cyclohexyl-3-[4-keto-2-[[2-keto-2-(sec-butylamino)ethyl]thio]quinazolin-3-yl]propionamide Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCC(=O)NC3CCCCC3

Isomeric SMILES

CCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCC(=O)NC3CCCCC3

InChI

InChI=1S/C23H32N4O3S/c1-3-16(2)24-21(29)15-31-23-26-19-12-8-7-11-18(19)22(30)27(23)14-13-20(28)25-17-9-5-4-6-10-17/h7-8,11-12,16-17H,3-6,9-10,13-15H2,1-2H3,(H,24,29)(H,25,28)