N-(1,3-benzothiazol-2-yl)-N-[[(2R)-oxolan-2-yl]methyl]-4-pyrazol-1-yl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-[[(2R)-oxolan-2-yl]methyl]-4-pyrazol-1-yl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-pyrazol-1-yl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-[[(2R)-2-oxolanyl]methyl]-4-(1-pyrazolyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-[[(2R)-oxolan-2-yl]methyl]-4-pyrazol-1-ylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-pyrazol-1-yl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(C2=NC3=CC=CC=C3S2)C(=O)C4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

C1C[C@@H](OC1)CN(C2=NC3=CC=CC=C3S2)C(=O)C4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C22H20N4O2S/c27-21(16-8-10-17(11-9-16)26-13-4-12-23-26)25(15-18-5-3-14-28-18)22-24-19-6-1-2-7-20(19)29-22/h1-2,4,6-13,18H,3,5,14-15H2/t18-/m1/s1