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

Systemtic Name: N-(2-phenylpyrimidin-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(2-phenylpyrimidin-5-yl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(2-phenyl-5-pyrimidinyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(2-phenylpyrimidin-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(2-phenylpyrimidin-5-yl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C19H17N3OS MolecularWeight: 335.42278

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)NC3=CN=C(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)NC3=CN=C(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C19H17N3OS/c23-19(16-12-24-17-9-5-4-8-15(16)17)22-14-10-20-18(21-11-14)13-6-2-1-3-7-13/h1-3,6-7,10-12H,4-5,8-9H2,(H,22,23)