N-(1-pyrimidin-2-ylpiperidin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(1-pyrimidin-2-ylpiperidin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-(1-pyrimidin-2-yl-3-piperidyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-[1-(2-pyrimidinyl)-3-piperidinyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-(1-pyrimidin-2-ylpiperidin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-[1-(2-pyrimidyl)-3-piperidyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C18H22N4OS MolecularWeight: 342.45848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(S2)C(=O)NC3CCCN(C3)C4=NC=CC=N4

Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)NC3CCCN(C3)C4=NC=CC=N4

InChI

InChI=1S/C18H22N4OS/c23-17(16-11-13-5-1-2-7-15(13)24-16)21-14-6-3-10-22(12-14)18-19-8-4-9-20-18/h4,8-9,11,14H,1-3,5-7,10,12H2,(H,21,23)