N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(2-phenylethanoylamino)propanamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(2-phenylethanoylamino)propanamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-[(2-phenylacetyl)amino]propanamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-[(1-oxo-2-phenylethyl)amino]propanamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-[(2-phenylacetyl)amino]propanamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-[(2-phenylacetyl)amino]propionamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NCCC(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NCCC(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H23N3O2S/c29-23(14-15-26-24(30)16-18-6-2-1-3-7-18)27-20-12-10-19(11-13-20)17-25-28-21-8-4-5-9-22(21)31-25/h1-13H,14-17H2,(H,26,30)(H,27,29)