N-(2-cyanoethyl)-2-[[1,3-dimethyl-2,4-bis(oxidanylidene)quinazolin-6-yl]sulfonyl-methyl-amino]-N-methyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[[1,3-dimethyl-2,4-bis(oxidanylidene)quinazolin-6-yl]sulfonyl-methyl-amino]-N-methyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[(1,3-dimethyl-2,4-dioxo-quinazolin-6-yl)sulfonyl-methyl-amino]-N-methyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(1,3-dimethyl-2,4-dioxo-6-quinazolinyl)sulfonyl-methylamino]-N-methylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[(1,3-dimethyl-2,4-dioxoquinazolin-6-yl)sulfonyl-methylamino]-N-methylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(2,4-diketo-1,3-dimethyl-quinazolin-6-yl)sulfonyl-methyl-amino]-N-methyl-acetamide Formula: C17H21N5O5S MolecularWeight: 407.44414

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)N(C)CCC#N)C(=O)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)N(C)CCC#N)C(=O)N(C1=O)C

InChI

InChI=1S/C17H21N5O5S/c1-19(9-5-8-18)15(23)11-20(2)28(26,27)12-6-7-14-13(10-12)16(24)22(4)17(25)21(14)3/h6-7,10H,5,9,11H2,1-4H3