N-tert-butyl-2-[2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl-methyl-amino]ethanamide

Systemtic Name: N-tert-butyl-2-[2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl-methyl-amino]ethanamide Openeye Name: N-tert-butyl-2-[[2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]-methyl-amino]acetamide CAS Name: N-tert-butyl-2-[[2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]-methylamino]acetamide IUPAC Name: N-tert-butyl-2-[[2-(3-butyl-4-oxoquinazolin-2-yl)sulfanylacetyl]-methylamino]acetamide Traditional Name: N-tert-butyl-2-[[2-[(3-butyl-4-keto-quinazolin-2-yl)thio]acetyl]-methyl-amino]acetamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)CC(=O)NC(C)(C)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)CC(=O)NC(C)(C)C

InChI

InChI=1S/C21H30N4O3S/c1-6-7-12-25-19(28)15-10-8-9-11-16(15)22-20(25)29-14-18(27)24(5)13-17(26)23-21(2,3)4/h8-11H,6-7,12-14H2,1-5H3,(H,23,26)