N-methyl-3-phenethyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethyl)-1,2-oxazole-5-carboxamide

Systemtic Name: N-methyl-3-phenethyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethyl)-1,2-oxazole-5-carboxamide Openeye Name: N-methyl-3-phenethyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethyl)isoxazole-5-carboxamide CAS Name: N-methyl-3-phenethyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethyl)-5-isoxazolecarboxamide IUPAC Name: N-methyl-3-phenethyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethyl)-1,2-oxazole-5-carboxamide Traditional Name: N-methyl-3-phenethyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylmethyl)isoxazole-5-carboxamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=C(S1)CCCC2)C(=O)C3=CC(=NO3)CCC4=CC=CC=C4

Isomeric SMILES

CN(CC1=NC2=C(S1)CCCC2)C(=O)C3=CC(=NO3)CCC4=CC=CC=C4

InChI

InChI=1S/C21H23N3O2S/c1-24(14-20-22-17-9-5-6-10-19(17)27-20)21(25)18-13-16(23-26-18)12-11-15-7-3-2-4-8-15/h2-4,7-8,13H,5-6,9-12,14H2,1H3