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

Systemtic Name: 2-[(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]methyl]-1-ethyl-N,N-dimethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylmethyl]-1-ethyl-N,N-dimethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[(3-cyclopropyl-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)N3C5CC5

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CSC3=NC4=CC=CC=C4C(=O)N3C5CC5

InChI

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