N-[4-[1-[2-(1,3-benzothiazol-2-ylmethoxy)ethanoylamino]ethyl]phenyl]propanamide

Systemtic Name: N-[4-[1-[2-(1,3-benzothiazol-2-ylmethoxy)ethanoylamino]ethyl]phenyl]propanamide Openeye Name: N-[4-[1-[[2-(1,3-benzothiazol-2-ylmethoxy)acetyl]amino]ethyl]phenyl]propanamide CAS Name: N-[4-[1-[[2-(1,3-benzothiazol-2-ylmethoxy)-1-oxoethyl]amino]ethyl]phenyl]propanamide IUPAC Name: N-[4-[1-[[2-(1,3-benzothiazol-2-ylmethoxy)acetyl]amino]ethyl]phenyl]propanamide Traditional Name: N-[4-[1-[[2-(1,3-benzothiazol-2-ylmethoxy)acetyl]amino]ethyl]phenyl]propionamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(C)NC(=O)COCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(C)NC(=O)COCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H23N3O3S/c1-3-19(25)23-16-10-8-15(9-11-16)14(2)22-20(26)12-27-13-21-24-17-6-4-5-7-18(17)28-21/h4-11,14H,3,12-13H2,1-2H3,(H,22,26)(H,23,25)