3-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]propanamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]propanamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(5-methyl-1-phenyl-4-pyrazolyl)ethyl]propanamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(5-methyl-1-phenylpyrazol-4-yl)ethyl]propanamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]propionamide Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(C)NC(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)[C@H](C)NC(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H22N4OS/c1-15(18-14-23-26(16(18)2)17-8-4-3-5-9-17)24-21(27)12-13-22-25-19-10-6-7-11-20(19)28-22/h3-11,14-15H,12-13H2,1-2H3,(H,24,27)/t15-/m0/s1