N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-N-ethyl-1-mesyl-isonipecotamide Formula: C18H23ClN4O4S MolecularWeight: 426.91762

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C18H23ClN4O4S/c1-3-22(18(25)12-6-8-23(9-7-12)28(2,26)27)11-16-20-15-10-13(19)4-5-14(15)17(24)21-16/h4-5,10,12H,3,6-9,11H2,1-2H3,(H,20,21,24)