N-ethyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-ethyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-ethyl-N-[(4-keto-1H-quinazolin-2-yl)methyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H24N4O4S2 MolecularWeight: 460.56966

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H24N4O4S2/c1-2-24(14-18-22-17-7-4-3-6-16(17)20(26)23-18)21(27)15-9-11-25(12-10-15)31(28,29)19-8-5-13-30-19/h3-8,13,15H,2,9-12,14H2,1H3,(H,22,23,26)