[3-bromanyl-4-(morpholin-4-ylmethyl)phenyl]-[2-(dimethylamino)-6-methoxy-1-benzothiophen-3-yl]methanone

Systemtic Name: [3-bromanyl-4-(morpholin-4-ylmethyl)phenyl]-[2-(dimethylamino)-6-methoxy-1-benzothiophen-3-yl]methanone Openeye Name: [3-bromo-4-(morpholinomethyl)phenyl]-[2-(dimethylamino)-6-methoxy-benzothiophen-3-yl]methanone CAS Name: [3-bromo-4-(4-morpholinylmethyl)phenyl]-[2-(dimethylamino)-6-methoxy-1-benzothiophen-3-yl]methanone IUPAC Name: [3-bromo-4-(morpholin-4-ylmethyl)phenyl]-[2-(dimethylamino)-6-methoxy-1-benzothiophen-3-yl]methanone Traditional Name: [3-bromo-4-(morpholinomethyl)phenyl]-[2-(dimethylamino)-6-methoxy-benzothiophen-3-yl]methanone Formula: C23H25BrN2O3S MolecularWeight: 489.4252

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C2=C(S1)C=C(C=C2)OC)C(=O)C3=CC(=C(C=C3)CN4CCOCC4)Br

Isomeric SMILES

CN(C)C1=C(C2=C(S1)C=C(C=C2)OC)C(=O)C3=CC(=C(C=C3)CN4CCOCC4)Br

InChI

InChI=1S/C23H25BrN2O3S/c1-25(2)23-21(18-7-6-17(28-3)13-20(18)30-23)22(27)15-4-5-16(19(24)12-15)14-26-8-10-29-11-9-26/h4-7,12-13H,8-11,14H2,1-3H3