1-ethyl-N,N-dimethyl-2-[(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-ethyl-N,N-dimethyl-2-[(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]benzimidazole-5-sulfonamide Openeye Name: 2-[(3-allyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide CAS Name: 1-ethyl-N,N-dimethyl-2-[[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-N,N-dimethyl-2-[(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylmethyl]benzimidazole-5-sulfonamide Traditional Name: 2-[[(3-allyl-4-keto-quinazolin-2-yl)thio]methyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide Formula: C23H25N5O3S2 MolecularWeight: 483.6063

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CSC3=NC4=CC=CC=C4C(=O)N3CC=C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CSC3=NC4=CC=CC=C4C(=O)N3CC=C

InChI

InChI=1S/C23H25N5O3S2/c1-5-13-28-22(29)17-9-7-8-10-18(17)25-23(28)32-15-21-24-19-14-16(33(30,31)26(3)4)11-12-20(19)27(21)6-2/h5,7-12,14H,1,6,13,15H2,2-4H3