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

Systemtic Name: (2R)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-(cyclohexylamino)propanamide Openeye Name: (2R)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-(cyclohexylamino)propanamide CAS Name: (2R)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-(cyclohexylamino)propanamide IUPAC Name: (2R)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-(cyclohexylamino)propanamide Traditional Name: (2R)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-(cyclohexylamino)propionamide Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)CC2=NC3=CC=CC=C3S2)NC4CCCCC4

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)CC2=NC3=CC=CC=C3S2)NC4CCCCC4

InChI

InChI=1S/C23H27N3OS/c1-16(24-18-7-3-2-4-8-18)23(27)25-19-13-11-17(12-14-19)15-22-26-20-9-5-6-10-21(20)28-22/h5-6,9-14,16,18,24H,2-4,7-8,15H2,1H3,(H,25,27)/t16-/m1/s1