3-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethanoyl-phenyl-amino]propanamide

Systemtic Name: 3-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethanoyl-phenyl-amino]propanamide Openeye Name: 3-(N-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]acetyl]anilino)propanamide CAS Name: 3-(N-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-1-oxoethyl]anilino)propanamide IUPAC Name: 3-(N-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]acetyl]anilino)propanamide Traditional Name: 3-(N-[2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]acetyl]anilino)propionamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)CC(=O)N(CCC(=O)N)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)CC(=O)N(CCC(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O2S/c1-23(13-19-22-16-9-5-6-10-17(16)27-19)14-20(26)24(12-11-18(21)25)15-7-3-2-4-8-15/h2-10H,11-14H2,1H3,(H2,21,25)