N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-ethyl-5-methyl-isoxazole-4-carboxamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-ethyl-5-methyl-4-isoxazolecarboxamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-ethyl-5-methyl-isoxazole-4-carboxamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C21H19N3O2S/c1-3-16-20(13(2)26-24-16)21(25)22-15-10-8-14(9-11-15)12-19-23-17-6-4-5-7-18(17)27-19/h4-11H,3,12H2,1-2H3,(H,22,25)