N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-3-(2-methylpyrimidin-4-yl)benzenesulfonamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-3-(2-methylpyrimidin-4-yl)benzenesulfonamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-2-thienyl]-3-(2-methylpyrimidin-4-yl)benzenesulfonamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-2-thiophenyl]-3-(2-methyl-4-pyrimidinyl)benzenesulfonamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-3-(2-methylpyrimidin-4-yl)benzenesulfonamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-2-thienyl]-3-(2-methylpyrimidin-4-yl)benzenesulfonamide Formula: C22H16N4O2S3 MolecularWeight: 464.58304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)C2=CC(=CC=C2)S(=O)(=O)NC3=C(C=CS3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=NC=CC(=N1)C2=CC(=CC=C2)S(=O)(=O)NC3=C(C=CS3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H16N4O2S3/c1-14-23-11-9-18(24-14)15-5-4-6-16(13-15)31(27,28)26-22-17(10-12-29-22)21-25-19-7-2-3-8-20(19)30-21/h2-13,26H,1H3