N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-2-(3-isopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-methyl-acetamide CAS Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-2-[[3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-2-[3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-2-[(3-isoamyl-4-keto-quinazolin-2-yl)thio]-N-methyl-acetamide Formula: C25H28N4O2S2 MolecularWeight: 480.64542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)C(C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)C(C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H28N4O2S2/c1-16(2)13-14-29-24(31)18-9-5-6-10-19(18)27-25(29)32-15-22(30)28(4)17(3)23-26-20-11-7-8-12-21(20)33-23/h5-12,16-17H,13-15H2,1-4H3