N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3,5-dimethylisoxazol-4-yl)propanamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3,5-dimethyl-4-isoxazolyl)propanamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3,5-dimethylisoxazol-4-yl)propionamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CCC(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C(=NO1)C)CCC(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H21N3O2S/c1-14-18(15(2)27-25-14)11-12-21(26)23-17-9-7-16(8-10-17)13-22-24-19-5-3-4-6-20(19)28-22/h3-10H,11-13H2,1-2H3,(H,23,26)