N-aminocarbonyl-3-methyl-2-[3-(4-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide

Systemtic Name: N-aminocarbonyl-3-methyl-2-[3-(4-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide Openeye Name: N-carbamoyl-3-methyl-2-[3-(4-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanyl-butanamide CAS Name: N-carbamoyl-3-methyl-2-[[3-(4-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]butanamide IUPAC Name: N-carbamoyl-3-methyl-2-[3-(4-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanylbutanamide Traditional Name: N-carbamoyl-2-[[4-keto-3-(4-methyl-2-pyridyl)quinazolin-2-yl]thio]-3-methyl-butyramide Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C20H21N5O3S/c1-11(2)16(17(26)24-19(21)28)29-20-23-14-7-5-4-6-13(14)18(27)25(20)15-10-12(3)8-9-22-15/h4-11,16H,1-3H3,(H3,21,24,26,28)