N-[(3-chlorophenyl)methyl]-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide Openeye Name: N-[(3-chlorophenyl)methyl]-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide CAS Name: N-[(3-chlorophenyl)methyl]-1-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: N-[(3-chlorophenyl)methyl]-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide Traditional Name: N-(3-chlorobenzyl)-1-(6-ethylthieno[2,3-d]pyrimidin-4-yl)isonipecotamide Formula: C21H23ClN4OS MolecularWeight: 414.95152

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCC(CC3)C(=O)NCC4=CC(=CC=C4)Cl

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCC(CC3)C(=O)NCC4=CC(=CC=C4)Cl

InChI

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