N-[5-(cyclopropylsulfamoyl)-2-methoxy-phenyl]-2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[5-(cyclopropylsulfamoyl)-2-methoxy-phenyl]-2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[5-(cyclopropylsulfamoyl)-2-methoxy-phenyl]-2-(3,6-dimethyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[(3,6-dimethyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-(3,6-dimethyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[5-(cyclopropylsulfamoyl)-2-methoxy-phenyl]-2-[(4-keto-3,6-dimethyl-quinazolin-2-yl)thio]acetamide Formula: C22H24N4O5S2 MolecularWeight: 488.57976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N(C2=O)C)SCC(=O)NC3=C(C=CC(=C3)S(=O)(=O)NC4CC4)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N(C2=O)C)SCC(=O)NC3=C(C=CC(=C3)S(=O)(=O)NC4CC4)OC

InChI

InChI=1S/C22H24N4O5S2/c1-13-4-8-17-16(10-13)21(28)26(2)22(24-17)32-12-20(27)23-18-11-15(7-9-19(18)31-3)33(29,30)25-14-5-6-14/h4,7-11,14,25H,5-6,12H2,1-3H3,(H,23,27)