1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide

Systemtic Name: 1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide Openeye Name: 1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-N-[1-(2-thienyl)propyl]piperidine-3-carboxamide CAS Name: 1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-N-(1-thiophen-2-ylpropyl)-3-piperidinecarboxamide IUPAC Name: 1-(4-methyl-7-methylsulfonylquinazolin-2-yl)-N-(1-thiophen-2-ylpropyl)piperidine-3-carboxamide Traditional Name: 1-(7-mesyl-4-methyl-quinazolin-2-yl)-N-[1-(2-thienyl)propyl]nipecotamide Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CS1)NC(=O)C2CCCN(C2)C3=NC4=C(C=CC(=C4)S(=O)(=O)C)C(=N3)C

Isomeric SMILES

CCC(C1=CC=CS1)NC(=O)C2CCCN(C2)C3=NC4=C(C=CC(=C4)S(=O)(=O)C)C(=N3)C

InChI

InChI=1S/C23H28N4O3S2/c1-4-19(21-8-6-12-31-21)25-22(28)16-7-5-11-27(14-16)23-24-15(2)18-10-9-17(32(3,29)30)13-20(18)26-23/h6,8-10,12-13,16,19H,4-5,7,11,14H2,1-3H3,(H,25,28)