(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 5-[2-(methylsulfonylamino)ethyl]thiophene-2-carboxylate

Systemtic Name: (8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 5-[2-(methylsulfonylamino)ethyl]thiophene-2-carboxylate Openeye Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxylate CAS Name: 5-[2-(methanesulfonamido)ethyl]-2-thiophenecarboxylic acid (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxylate Traditional Name: 5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxylic acid (4-keto-8-methyl-1H-quinazolin-2-yl)methyl ester Formula: C18H19N3O5S2 MolecularWeight: 421.49056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)C3=CC=C(S3)CCNS(=O)(=O)C

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)C3=CC=C(S3)CCNS(=O)(=O)C

InChI

InChI=1S/C18H19N3O5S2/c1-11-4-3-5-13-16(11)20-15(21-17(13)22)10-26-18(23)14-7-6-12(27-14)8-9-19-28(2,24)25/h3-7,19H,8-10H2,1-2H3,(H,20,21,22)