N-[(2,4-dimethylphenyl)carbamoyl]-2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-[(2,4-dimethylanilino)-oxomethyl]-2-[[4-oxo-3-(2-oxolanylmethyl)-2-quinazolinyl]thio]propanamide IUPAC Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[4-oxo-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanylpropanamide Traditional Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-[[4-keto-3-(tetrahydrofurfuryl)quinazolin-2-yl]thio]propionamide Formula: C25H28N4O4S MolecularWeight: 480.57922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CC4CCCO4)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CC4CCCO4)C

InChI

InChI=1S/C25H28N4O4S/c1-15-10-11-20(16(2)13-15)26-24(32)28-22(30)17(3)34-25-27-21-9-5-4-8-19(21)23(31)29(25)14-18-7-6-12-33-18/h4-5,8-11,13,17-18H,6-7,12,14H2,1-3H3,(H2,26,28,30,32)