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

Systemtic Name: 1-butylsulfonyl-N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-butylsulfonyl-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]piperidine-4-carboxamide CAS Name: 1-butylsulfonyl-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-butylsulfonyl-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-butylsulfonyl-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-isonipecotamide Formula: C20H28N4O4S MolecularWeight: 420.52572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCC(CC1)C(=O)N(C)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCCS(=O)(=O)N1CCC(CC1)C(=O)N(C)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C20H28N4O4S/c1-3-4-13-29(27,28)24-11-9-15(10-12-24)20(26)23(2)14-18-21-17-8-6-5-7-16(17)19(25)22-18/h5-8,15H,3-4,9-14H2,1-2H3,(H,21,22,25)