N-(2-methylsulfanylethyl)-1-(4,6,7-trimethylquinazolin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(2-methylsulfanylethyl)-1-(4,6,7-trimethylquinazolin-2-yl)piperidine-4-carboxamide Openeye Name: N-(2-methylsulfanylethyl)-1-(4,6,7-trimethylquinazolin-2-yl)piperidine-4-carboxamide CAS Name: N-[2-(methylthio)ethyl]-1-(4,6,7-trimethyl-2-quinazolinyl)-4-piperidinecarboxamide IUPAC Name: N-(2-methylsulfanylethyl)-1-(4,6,7-trimethylquinazolin-2-yl)piperidine-4-carboxamide Traditional Name: N-[2-(methylthio)ethyl]-1-(4,6,7-trimethylquinazolin-2-yl)isonipecotamide Formula: C20H28N4OS MolecularWeight: 372.52752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)C(=O)NCCSC)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)C(=O)NCCSC)C)C

InChI

InChI=1S/C20H28N4OS/c1-13-11-17-15(3)22-20(23-18(17)12-14(13)2)24-8-5-16(6-9-24)19(25)21-7-10-26-4/h11-12,16H,5-10H2,1-4H3,(H,21,25)