4-[(cyclobutylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-[(cyclobutylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-[(cyclobutylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-[(cyclobutylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-[(cyclobutylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-[(cyclobutylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3=CC=CC=C3)SC(=N2)NC(=O)C4=CC=C(C=C4)CNC5CCC5

Isomeric SMILES

COC1=C2C(=C(C=C1)C3=CC=CC=C3)SC(=N2)NC(=O)C4=CC=C(C=C4)CNC5CCC5

InChI

InChI=1S/C26H25N3O2S/c1-31-22-15-14-21(18-6-3-2-4-7-18)24-23(22)28-26(32-24)29-25(30)19-12-10-17(11-13-19)16-27-20-8-5-9-20/h2-4,6-7,10-15,20,27H,5,8-9,16H2,1H3,(H,28,29,30)