6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]hexanamide

Systemtic Name: 6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]hexanamide Openeye Name: N-[2-(4-isopropoxyphenyl)ethyl]-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: 6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]hexanamide IUPAC Name: 6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]hexanamide Traditional Name: N-[2-(4-isopropoxyphenyl)ethyl]-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanamide Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)CCNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)CCNC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C25H31N3O3S/c1-18(2)31-20-13-11-19(12-14-20)15-16-26-23(29)10-4-3-7-17-28-24(30)21-8-5-6-9-22(21)27-25(28)32/h5-6,8-9,11-14,18H,3-4,7,10,15-17H2,1-2H3,(H,26,29)(H,27,32)