2-azanyl-4-(4-bromanylthiophen-2-yl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-bromanylthiophen-2-yl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-bromo-2-thienyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-(4-bromo-2-thiophenyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-bromothiophen-2-yl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-bromo-2-thienyl)-6-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C20H16BrN3S MolecularWeight: 410.33014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C3=CC=CC=C3)C(=C(C(=N2)N)C#N)C4=CC(=CS4)Br

Isomeric SMILES

C1CC2=C(CC1C3=CC=CC=C3)C(=C(C(=N2)N)C#N)C4=CC(=CS4)Br

InChI

InChI=1S/C20H16BrN3S/c21-14-9-18(25-11-14)19-15-8-13(12-4-2-1-3-5-12)6-7-17(15)24-20(23)16(19)10-22/h1-5,9,11,13H,6-8H2,(H2,23,24)