N-butyl-2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide

Systemtic Name: N-butyl-2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide Openeye Name: N-butyl-2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-quinazolin-2-yl]sulfanyl-butanamide CAS Name: N-butyl-2-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-quinazolinyl]thio]butanamide IUPAC Name: N-butyl-2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxoquinazolin-2-yl]sulfanylbutanamide Traditional Name: N-butyl-2-[(3-homoveratryl-4-keto-quinazolin-2-yl)thio]butyramide Formula: C26H33N3O4S MolecularWeight: 483.62292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(CC)SC1=NC2=CC=CC=C2C(=O)N1CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCNC(=O)C(CC)SC1=NC2=CC=CC=C2C(=O)N1CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C26H33N3O4S/c1-5-7-15-27-24(30)23(6-2)34-26-28-20-11-9-8-10-19(20)25(31)29(26)16-14-18-12-13-21(32-3)22(17-18)33-4/h8-13,17,23H,5-7,14-16H2,1-4H3,(H,27,30)