3-[5-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-3-oxidanylidene-2H-imidazo[1,2-c]quinazolin-2-yl]-N-phenethyl-propanamide

Systemtic Name: 3-[5-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-3-oxidanylidene-2H-imidazo[1,2-c]quinazolin-2-yl]-N-phenethyl-propanamide Openeye Name: 3-[3-oxo-5-[2-oxo-2-(sec-butylamino)ethyl]sulfanyl-2H-imidazo[1,2-c]quinazolin-2-yl]-N-phenethyl-propanamide CAS Name: 3-[5-[[2-(butan-2-ylamino)-2-oxoethyl]thio]-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]-N-phenethylpropanamide IUPAC Name: 3-[5-[2-(butan-2-ylamino)-2-oxoethyl]sulfanyl-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]-N-phenethylpropanamide Traditional Name: 3-[3-keto-5-[[2-keto-2-(sec-butylamino)ethyl]thio]-2H-imidazo[1,2-c]quinazolin-2-yl]-N-phenethyl-propionamide Formula: C27H31N5O3S MolecularWeight: 505.63174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC2=CC=CC=C2C3=NC(C(=O)N31)CCC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CCC(C)NC(=O)CSC1=NC2=CC=CC=C2C3=NC(C(=O)N31)CCC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C27H31N5O3S/c1-3-18(2)29-24(34)17-36-27-31-21-12-8-7-11-20(21)25-30-22(26(35)32(25)27)13-14-23(33)28-16-15-19-9-5-4-6-10-19/h4-12,18,22H,3,13-17H2,1-2H3,(H,28,33)(H,29,34)