N-[6-[2-(4-methoxyphenyl)sulfanylpyrimidin-4-yl]-1,3-benzothiazol-2-yl]ethanamide

Systemtic Name: N-[6-[2-(4-methoxyphenyl)sulfanylpyrimidin-4-yl]-1,3-benzothiazol-2-yl]ethanamide Openeye Name: N-[6-[2-(4-methoxyphenyl)sulfanylpyrimidin-4-yl]-1,3-benzothiazol-2-yl]acetamide CAS Name: N-[6-[2-[(4-methoxyphenyl)thio]-4-pyrimidinyl]-1,3-benzothiazol-2-yl]acetamide IUPAC Name: N-[6-[2-(4-methoxyphenyl)sulfanylpyrimidin-4-yl]-1,3-benzothiazol-2-yl]acetamide Traditional Name: N-[6-[2-[(4-methoxyphenyl)thio]pyrimidin-4-yl]-1,3-benzothiazol-2-yl]acetamide Formula: C20H16N4O2S2 MolecularWeight: 408.49664

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(S1)C=C(C=C2)C3=NC(=NC=C3)SC4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)NC1=NC2=C(S1)C=C(C=C2)C3=NC(=NC=C3)SC4=CC=C(C=C4)OC

InChI

InChI=1S/C20H16N4O2S2/c1-12(25)22-20-24-17-8-3-13(11-18(17)28-20)16-9-10-21-19(23-16)27-15-6-4-14(26-2)5-7-15/h3-11H,1-2H3,(H,22,24,25)