N-[6-[2-(2-pyridin-3-ylethoxy)pyrimidin-4-yl]-1,3-benzothiazol-2-yl]ethanamide

Systemtic Name: N-[6-[2-(2-pyridin-3-ylethoxy)pyrimidin-4-yl]-1,3-benzothiazol-2-yl]ethanamide Openeye Name: N-[6-[2-[2-(3-pyridyl)ethoxy]pyrimidin-4-yl]-1,3-benzothiazol-2-yl]acetamide CAS Name: N-[6-[2-[2-(3-pyridinyl)ethoxy]-4-pyrimidinyl]-1,3-benzothiazol-2-yl]acetamide IUPAC Name: N-[6-[2-(2-pyridin-3-ylethoxy)pyrimidin-4-yl]-1,3-benzothiazol-2-yl]acetamide Traditional Name: N-[6-[2-[2-(3-pyridyl)ethoxy]pyrimidin-4-yl]-1,3-benzothiazol-2-yl]acetamide Formula: C20H17N5O2S MolecularWeight: 391.44628

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(S1)C=C(C=C2)C3=NC(=NC=C3)OCCC4=CN=CC=C4

Isomeric SMILES

CC(=O)NC1=NC2=C(S1)C=C(C=C2)C3=NC(=NC=C3)OCCC4=CN=CC=C4

InChI

InChI=1S/C20H17N5O2S/c1-13(26)23-20-25-17-5-4-15(11-18(17)28-20)16-6-9-22-19(24-16)27-10-7-14-3-2-8-21-12-14/h2-6,8-9,11-12H,7,10H2,1H3,(H,23,25,26)