2-azanyl-4-[4-[(4-bromanylphenoxy)methyl]-5-ethyl-thiophen-2-yl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-[4-[(4-bromanylphenoxy)methyl]-5-ethyl-thiophen-2-yl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-[4-[(4-bromophenoxy)methyl]-5-ethyl-2-thienyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-[4-[(4-bromophenoxy)methyl]-5-ethyl-2-thiophenyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-[4-[(4-bromophenoxy)methyl]-5-ethylthiophen-2-yl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-[4-[(4-bromophenoxy)methyl]-5-ethyl-2-thienyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C23H22BrN3OS MolecularWeight: 468.40928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C2=C(C(=NC3=C2CCCC3)N)C#N)COC4=CC=C(C=C4)Br

Isomeric SMILES

CCC1=C(C=C(S1)C2=C(C(=NC3=C2CCCC3)N)C#N)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C23H22BrN3OS/c1-2-20-14(13-28-16-9-7-15(24)8-10-16)11-21(29-20)22-17-5-3-4-6-19(17)27-23(26)18(22)12-25/h7-11H,2-6,13H2,1H3,(H2,26,27)