N-(1H-benzimidazol-2-yl)-2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1H-benzimidazol-2-yl)-2-(3-isopentyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(1H-benzimidazol-2-yl)-2-[[3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(1H-benzimidazol-2-yl)-2-[3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(1H-benzimidazol-2-yl)-2-[(3-isoamyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H23N5O2S/c1-14(2)11-12-27-20(29)15-7-3-4-8-16(15)25-22(27)30-13-19(28)26-21-23-17-9-5-6-10-18(17)24-21/h3-10,14H,11-13H2,1-2H3,(H2,23,24,26,28)