N-methyl-2-[3-(7-methyloctyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-methyl-2-[3-(7-methyloctyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-methyl-2-[3-(7-methyloctyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-methyl-2-[[3-(7-methyloctyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-methyl-2-[3-(7-methyloctyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-keto-3-(7-methyloctyl)quinazolin-2-yl]thio]-N-methyl-acetamide Formula: C20H29N3O2S MolecularWeight: 375.52816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC

Isomeric SMILES

CC(C)CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC

InChI

InChI=1S/C20H29N3O2S/c1-15(2)10-6-4-5-9-13-23-19(25)16-11-7-8-12-17(16)22-20(23)26-14-18(24)21-3/h7-8,11-12,15H,4-6,9-10,13-14H2,1-3H3,(H,21,24)