N-[(4-tert-butylphenyl)methyl]-N-methyl-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide

Systemtic Name: N-[(4-tert-butylphenyl)methyl]-N-methyl-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-N-methyl-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: N-[(4-tert-butylphenyl)methyl]-N-methyl-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-N-methyl-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Traditional Name: N-(4-tert-butylbenzyl)-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-methyl-hexanamide Formula: C26H33N3O2S MolecularWeight: 451.62412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(C)C(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(C)C(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C26H33N3O2S/c1-26(2,3)20-15-13-19(14-16-20)18-28(4)23(30)12-6-5-9-17-29-24(31)21-10-7-8-11-22(21)27-25(29)32/h7-8,10-11,13-16H,5-6,9,12,17-18H2,1-4H3,(H,27,32)