N-[(5-chloranylthiophen-2-yl)methyl]-1-(4,7-dimethylquinazolin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-1-(4,7-dimethylquinazolin-2-yl)piperidine-4-carboxamide Openeye Name: N-[(5-chloro-2-thienyl)methyl]-1-(4,7-dimethylquinazolin-2-yl)piperidine-4-carboxamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-1-(4,7-dimethyl-2-quinazolinyl)-4-piperidinecarboxamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-1-(4,7-dimethylquinazolin-2-yl)piperidine-4-carboxamide Traditional Name: N-[(5-chloro-2-thienyl)methyl]-1-(4,7-dimethylquinazolin-2-yl)isonipecotamide Formula: C21H23ClN4OS MolecularWeight: 414.95152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCC(CC3)C(=O)NCC4=CC=C(S4)Cl)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCC(CC3)C(=O)NCC4=CC=C(S4)Cl)C

InChI

InChI=1S/C21H23ClN4OS/c1-13-3-5-17-14(2)24-21(25-18(17)11-13)26-9-7-15(8-10-26)20(27)23-12-16-4-6-19(22)28-16/h3-6,11,15H,7-10,12H2,1-2H3,(H,23,27)