ethyl N-[4-methyl-1-[6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanoylamino]pentan-2-yl]carbamate

Systemtic Name: ethyl N-[4-methyl-1-[6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanoylamino]pentan-2-yl]carbamate Openeye Name: ethyl N-[3-methyl-1-[[6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanoylamino]methyl]butyl]carbamate CAS Name: N-[4-methyl-1-[[1-oxo-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexyl]amino]pentan-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-methyl-1-[6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanoylamino]pentan-2-yl]carbamate Traditional Name: N-[1-[[6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanoylamino]methyl]-3-methyl-butyl]carbamic acid ethyl ester Formula: C23H34N4O4S MolecularWeight: 462.60546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(CC(C)C)CNC(=O)CCCCCN1C(=O)C2=CC=CC=C2NC1=S

Isomeric SMILES

CCOC(=O)NC(CC(C)C)CNC(=O)CCCCCN1C(=O)C2=CC=CC=C2NC1=S

InChI

InChI=1S/C23H34N4O4S/c1-4-31-23(30)25-17(14-16(2)3)15-24-20(28)12-6-5-9-13-27-21(29)18-10-7-8-11-19(18)26-22(27)32/h7-8,10-11,16-17H,4-6,9,12-15H2,1-3H3,(H,24,28)(H,25,30)(H,26,32)