N-(1-ethylpiperidin-4-yl)-2-[3-(7-methyloctyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1-ethylpiperidin-4-yl)-2-[3-(7-methyloctyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1-ethyl-4-piperidyl)-2-[3-(7-methyloctyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(1-ethyl-4-piperidinyl)-2-[[3-(7-methyloctyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(1-ethylpiperidin-4-yl)-2-[3-(7-methyloctyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(1-ethyl-4-piperidyl)-2-[[4-keto-3-(7-methyloctyl)quinazolin-2-yl]thio]acetamide Formula: C26H40N4O2S MolecularWeight: 472.6864

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCCCCC(C)C

Isomeric SMILES

CCN1CCC(CC1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCCCCC(C)C

InChI

InChI=1S/C26H40N4O2S/c1-4-29-17-14-21(15-18-29)27-24(31)19-33-26-28-23-13-9-8-12-22(23)25(32)30(26)16-10-6-5-7-11-20(2)3/h8-9,12-13,20-21H,4-7,10-11,14-19H2,1-3H3,(H,27,31)