1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-N-[(1S)-1-thiophen-2-ylethyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-N-[(1S)-1-thiophen-2-ylethyl]piperidine-4-carboxamide Openeye Name: 1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-N-[(1S)-1-(2-thienyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-N-[(1S)-1-thiophen-2-ylethyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methyl-7-methylsulfonylquinazolin-2-yl)-N-[(1S)-1-thiophen-2-ylethyl]piperidine-4-carboxamide Traditional Name: 1-(7-mesyl-4-methyl-quinazolin-2-yl)-N-[(1S)-1-(2-thienyl)ethyl]isonipecotamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)NC(C)C4=CC=CS4

Isomeric SMILES

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)N[C@@H](C)C4=CC=CS4

InChI

InChI=1S/C22H26N4O3S2/c1-14-18-7-6-17(31(3,28)29)13-19(18)25-22(24-14)26-10-8-16(9-11-26)21(27)23-15(2)20-5-4-12-30-20/h4-7,12-13,15-16H,8-11H2,1-3H3,(H,23,27)/t15-/m0/s1