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

Systemtic Name: 4-[(cyclopropylmethylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-[(cyclopropylmethylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-[(cyclopropylmethylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-[(cyclopropylmethylamino)methyl]-N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-[(cyclopropylmethylamino)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)CNCC5CC5

Isomeric SMILES

COC1=C2C(=C(C=C1)C3=CC=CC=C3)SC(=N2)NC(=O)C4=CC=C(C=C4)CNCC5CC5

InChI

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