2-bromanyl-N-[4-methoxy-7-[methyl-(phenylmethyl)amino]-1,3-benzothiazol-2-yl]pyridine-4-carboxamide

Systemtic Name: 2-bromanyl-N-[4-methoxy-7-[methyl-(phenylmethyl)amino]-1,3-benzothiazol-2-yl]pyridine-4-carboxamide Openeye Name: N-[7-[benzyl(methyl)amino]-4-methoxy-1,3-benzothiazol-2-yl]-2-bromo-pyridine-4-carboxamide CAS Name: 2-bromo-N-[4-methoxy-7-[methyl-(phenylmethyl)amino]-1,3-benzothiazol-2-yl]-4-pyridinecarboxamide IUPAC Name: N-[7-[benzyl(methyl)amino]-4-methoxy-1,3-benzothiazol-2-yl]-2-bromopyridine-4-carboxamide Traditional Name: N-[7-[benzyl(methyl)amino]-4-methoxy-1,3-benzothiazol-2-yl]-2-bromo-isonicotinamide Formula: C22H19BrN4O2S MolecularWeight: 483.38086

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=C3C(=C(C=C2)OC)N=C(S3)NC(=O)C4=CC(=NC=C4)Br

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=C3C(=C(C=C2)OC)N=C(S3)NC(=O)C4=CC(=NC=C4)Br

InChI

InChI=1S/C22H19BrN4O2S/c1-27(13-14-6-4-3-5-7-14)16-8-9-17(29-2)19-20(16)30-22(25-19)26-21(28)15-10-11-24-18(23)12-15/h3-12H,13H2,1-2H3,(H,25,26,28)