N-(4-chloranyl-1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-N-(3-pyridylmethyl)acetamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-N-(3-pyridinylmethyl)acetamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)acetamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-2-(4-methoxyphenyl)-N-(3-pyridylmethyl)acetamide Formula: C22H18ClN3O2S MolecularWeight: 423.91522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)N(CC2=CN=CC=C2)C3=NC4=C(S3)C=CC=C4Cl

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)N(CC2=CN=CC=C2)C3=NC4=C(S3)C=CC=C4Cl

InChI

InChI=1S/C22H18ClN3O2S/c1-28-17-9-7-15(8-10-17)12-20(27)26(14-16-4-3-11-24-13-16)22-25-21-18(23)5-2-6-19(21)29-22/h2-11,13H,12,14H2,1H3