2-formamido-3-(4-hydroxyphenyl)-N-[2-(pyridin-3-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]propanamide

Systemtic Name: 2-formamido-3-(4-hydroxyphenyl)-N-[2-(pyridin-3-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]propanamide Openeye Name: 2-formamido-3-(4-hydroxyphenyl)-N-[2-(3-pyridylmethylsulfanyl)-1,3-benzothiazol-6-yl]propanamide CAS Name: 2-formamido-3-(4-hydroxyphenyl)-N-[2-(3-pyridinylmethylthio)-1,3-benzothiazol-6-yl]propanamide IUPAC Name: 2-formamido-3-(4-hydroxyphenyl)-N-[2-(pyridin-3-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]propanamide Traditional Name: 2-formamido-3-(4-hydroxyphenyl)-N-[2-(3-pyridylmethylthio)-1,3-benzothiazol-6-yl]propionamide Formula: C23H20N4O3S2 MolecularWeight: 464.5599

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C(CC4=CC=C(C=C4)O)NC=O

Isomeric SMILES

C1=CC(=CN=C1)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C(CC4=CC=C(C=C4)O)NC=O

InChI

InChI=1S/C23H20N4O3S2/c28-14-25-20(10-15-3-6-18(29)7-4-15)22(30)26-17-5-8-19-21(11-17)32-23(27-19)31-13-16-2-1-9-24-12-16/h1-9,11-12,14,20,29H,10,13H2,(H,25,28)(H,26,30)