3-methyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-methyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-benzothiophene-2-carboxamide Openeye Name: 3-methyl-N-(2-morpholino-1,3-benzothiazol-6-yl)benzothiophene-2-carboxamide CAS Name: 3-methyl-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-methyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-benzothiophene-2-carboxamide Traditional Name: 3-methyl-N-(2-morpholino-1,3-benzothiazol-6-yl)benzothiophene-2-carboxamide Formula: C21H19N3O2S2 MolecularWeight: 409.52446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)NC3=CC4=C(C=C3)N=C(S4)N5CCOCC5

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)NC3=CC4=C(C=C3)N=C(S4)N5CCOCC5

InChI

InChI=1S/C21H19N3O2S2/c1-13-15-4-2-3-5-17(15)27-19(13)20(25)22-14-6-7-16-18(12-14)28-21(23-16)24-8-10-26-11-9-24/h2-7,12H,8-11H2,1H3,(H,22,25)