N-[3-(4-bromophenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(diethylamino)ethanamide

Systemtic Name: N-[3-(4-bromophenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(diethylamino)ethanamide Openeye Name: N-[3-(4-bromobenzoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(diethylamino)acetamide CAS Name: N-[3-[(4-bromophenyl)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(diethylamino)acetamide IUPAC Name: N-[3-(4-bromobenzoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(diethylamino)acetamide Traditional Name: N-[3-(4-bromobenzoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-(diethylamino)acetamide Formula: C21H25BrN2O2S MolecularWeight: 449.4044

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCN(CC)CC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H25BrN2O2S/c1-3-24(4-2)13-18(25)23-21-19(16-7-5-6-8-17(16)27-21)20(26)14-9-11-15(22)12-10-14/h9-12H,3-8,13H2,1-2H3,(H,23,25)