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

Systemtic Name: 2-formamido-3-(4-hydroxyphenyl)-N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]propanamide Openeye Name: 2-formamido-3-(4-hydroxyphenyl)-N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]propanamide CAS Name: 2-formamido-3-(4-hydroxyphenyl)-N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]propanamide IUPAC Name: 2-formamido-3-(4-hydroxyphenyl)-N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]propanamide Traditional Name: 2-formamido-3-(4-hydroxyphenyl)-N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]propionamide Formula: C21H23N3O5S2 MolecularWeight: 461.55442

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C(CC3=CC=C(C=C3)O)NC=O

Isomeric SMILES

COCCOCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C(CC3=CC=C(C=C3)O)NC=O

InChI

InChI=1S/C21H23N3O5S2/c1-28-8-9-29-13-30-21-24-17-7-4-15(11-19(17)31-21)23-20(27)18(22-12-25)10-14-2-5-16(26)6-3-14/h2-7,11-12,18,26H,8-10,13H2,1H3,(H,22,25)(H,23,27)