N-(1,3-benzothiazol-2-ylmethyl)-3-[(4-ethoxyphenyl)sulfonylamino]propanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-3-[(4-ethoxyphenyl)sulfonylamino]propanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-3-[(4-ethoxyphenyl)sulfonylamino]propanamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-3-[(4-ethoxyphenyl)sulfonylamino]propanamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-3-[(4-ethoxyphenyl)sulfonylamino]propanamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-3-(p-phenetylsulfonylamino)propionamide Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H21N3O4S2/c1-2-26-14-7-9-15(10-8-14)28(24,25)21-12-11-18(23)20-13-19-22-16-5-3-4-6-17(16)27-19/h3-10,21H,2,11-13H2,1H3,(H,20,23)