3-(1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]propanamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]propanamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]propanamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)-2-thiophen-3-ylethyl]propanamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]propionamide Formula: C18H21N3OS2 MolecularWeight: 359.50884

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)CCC1=NC2=CC=CC=C2S1)C3=CSC=C3

Isomeric SMILES

CN(C)C(CNC(=O)CCC1=NC2=CC=CC=C2S1)C3=CSC=C3

InChI

InChI=1S/C18H21N3OS2/c1-21(2)15(13-9-10-23-12-13)11-19-17(22)7-8-18-20-14-5-3-4-6-16(14)24-18/h3-6,9-10,12,15H,7-8,11H2,1-2H3,(H,19,22)