(3-bromophenyl)-[3-[4-(2-diethylaminoethyloxy)phenyl]-1-oxidanylidene-1-benzothiophen-2-yl]methanone

Systemtic Name: (3-bromophenyl)-[3-[4-(2-diethylaminoethyloxy)phenyl]-1-oxidanylidene-1-benzothiophen-2-yl]methanone Openeye Name: (3-bromophenyl)-[3-[4-(2-diethylaminoethyloxy)phenyl]-1-oxo-benzothiophen-2-yl]methanone CAS Name: (3-bromophenyl)-[3-[4-(2-diethylaminoethyloxy)phenyl]-1-oxo-1-benzothiophen-2-yl]methanone IUPAC Name: (3-bromophenyl)-[3-[4-(2-diethylaminoethyloxy)phenyl]-1-oxo-1-benzothiophen-2-yl]methanone Traditional Name: (3-bromophenyl)-[3-[4-(2-diethylaminoethyloxy)phenyl]-1-keto-benzothiophen-2-yl]methanone Formula: C27H26BrNO3S MolecularWeight: 524.46924

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)C2=C(S(=O)C3=CC=CC=C32)C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)C2=C(S(=O)C3=CC=CC=C32)C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C27H26BrNO3S/c1-3-29(4-2)16-17-32-22-14-12-19(13-15-22)25-23-10-5-6-11-24(23)33(31)27(25)26(30)20-8-7-9-21(28)18-20/h5-15,18H,3-4,16-17H2,1-2H3