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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCCC(C3)C(=O)NCC4=CC(=CC=C4)Cl

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCCC(C3)C(=O)NCC4=CC(=CC=C4)Cl

InChI

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