(4S)-1-(5-bromanylpyridin-2-yl)-4-(3-methylthiophen-2-yl)-5-oxidanylidene-2-pyrrol-1-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: (4S)-1-(5-bromanylpyridin-2-yl)-4-(3-methylthiophen-2-yl)-5-oxidanylidene-2-pyrrol-1-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: (4S)-1-(5-bromo-2-pyridyl)-4-(3-methyl-2-thienyl)-5-oxo-2-pyrrol-1-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: (4S)-1-(5-bromo-2-pyridinyl)-4-(3-methyl-2-thiophenyl)-5-oxo-2-(1-pyrrolyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: (4S)-1-(5-bromopyridin-2-yl)-4-(3-methylthiophen-2-yl)-5-oxo-2-pyrrol-1-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: (4S)-1-(5-bromo-2-pyridyl)-5-keto-4-(3-methyl-2-thienyl)-2-pyrrol-1-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C24H19BrN4OS MolecularWeight: 491.40286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=NC=C(C=C4)Br)N5C=CC=C5)C#N

Isomeric SMILES

CC1=C(SC=C1)[C@H]2C(=C(N(C3=C2C(=O)CCC3)C4=NC=C(C=C4)Br)N5C=CC=C5)C#N

InChI

InChI=1S/C24H19BrN4OS/c1-15-9-12-31-23(15)21-17(13-26)24(28-10-2-3-11-28)29(20-8-7-16(25)14-27-20)18-5-4-6-19(30)22(18)21/h2-3,7-12,14,21H,4-6H2,1H3/t21-/m0/s1