2-azanyl-4-(4-bromanyl-5-methyl-thiophen-2-yl)-1-(2-bromophenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-bromanyl-5-methyl-thiophen-2-yl)-1-(2-bromophenyl)-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-bromo-5-methyl-2-thienyl)-1-(2-bromophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-bromo-5-methyl-2-thiophenyl)-1-(2-bromophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-bromo-5-methylthiophen-2-yl)-1-(2-bromophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-bromo-5-methyl-2-thienyl)-1-(2-bromophenyl)-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C21H17Br2N3OS MolecularWeight: 519.25218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC=C4Br)N)C#N)Br

Isomeric SMILES

CC1=C(C=C(S1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC=C4Br)N)C#N)Br

InChI

InChI=1S/C21H17Br2N3OS/c1-11-14(23)9-18(28-11)19-12(10-24)21(25)26(15-6-3-2-5-13(15)22)16-7-4-8-17(27)20(16)19/h2-3,5-6,9,19H,4,7-8,25H2,1H3