N-(2-cyanopropan-2-yl)-2-[3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-ethanamide

Systemtic Name: N-(2-cyanopropan-2-yl)-2-[3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-ethanamide Openeye Name: N-(1-cyano-1-methyl-ethyl)-2-[3-(3-ethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-methyl-acetamide CAS Name: N-(2-cyanopropan-2-yl)-2-[[3-(3-ethoxypropyl)-4-oxo-2-quinazolinyl]thio]-N-methylacetamide IUPAC Name: N-(2-cyanopropan-2-yl)-2-[3-(3-ethoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-methylacetamide Traditional Name: N-(1-cyano-1-methyl-ethyl)-2-[[3-(3-ethoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-methyl-acetamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)C(C)(C)C#N

Isomeric SMILES

CCOCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)C(C)(C)C#N

InChI

InChI=1S/C20H26N4O3S/c1-5-27-12-8-11-24-18(26)15-9-6-7-10-16(15)22-19(24)28-13-17(25)23(4)20(2,3)14-21/h6-7,9-10H,5,8,11-13H2,1-4H3